1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one

C211H234F5N53O20S10 — CID 161102344

IUPAC1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one
SMILESCOCC1CN(C(=O)c2nc(N[C@@H](C)c3cccc(F)c3)nc3nc(C)sc23)C1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@@H](CO)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@H](CO)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3ccccc3)nc(C(=O)N3CC[C@@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3ccccc3)nc(C(=O)N3CC[C@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3ccccn3)nc(C(=O)N3CC(CC(=O)Cc4ccccc4)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CC(CC(=O)CC(C)(C)C)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CC(CC(=O)CC4CCCC4)C3)c2s1
InChIInChI=1S/C26H26N6O2S.C25H30N6O2S.C24H30N6O2S.3C20H22FN5O2S.2C19H20FN5O2S.2C19H21N5O2S/c1-16(21-10-6-7-11-27-21)28-26-30-22(23-24(31-26)29-17(2)35-23)25(34)32-14-19(15-32)13-20(33)12-18-8-4-3-5-9-18;1-15(19-8-5-9-26-12-19)27-25-29-21(22-23(30-25)28-16(2)34-22)24(33)31-13-18(14-31)11-20(32)10-17-6-3-4-7-17;1-14(17-7-6-8-25-11-17)26-23-28-19(20-21(29-23)27-15(2)33-20)22(32)30-12-16(13-30)9-18(31)10-24(3,4)5;1-11(14-5-4-6-15(21)7-14)22-20-24-16(17-18(25-20)23-12(2)29-17)19(27)26-8-13(9-26)10-28-3;2*1-11(14-4-3-5-15(21)8-14)22-20-24-16(17-18(25-20)23-12(2)29-17)19(28)26-7-6-13(9-26)10-27;2*1-10(12-4-3-5-13(20)8-12)21-19-23-15(16-17(24-19)22-11(2)28-16)18(27)25-7-6-14(26)9-25;2*1-11(13-6-4-3-5-7-13)20-19-22-15(16-17(23-19)21-12(2)27-16)18(26)24-9-8-14(25)10-24/h3-11,16,19H,12-15H2,1-2H3,(H,28,30,31);5,8-9,12,15,17-18H,3-4,6-7,10-11,13-14H2,1-2H3,(H,27,29,30);6-8,11,14,16H,9-10,12-13H2,1-5H3,(H,26,28,29);4-7,11,13H,8-10H2,1-3H3,(H,22,24,25);2*3-5,8,11,13,27H,6-7,9-10H2,1-2H3,(H,22,24,25);2*3-5,8,10,14,26H,6-7,9H2,1-2H3,(H,21,23,24);2*3-7,11,14,25H,8-10H2,1-2H3,(H,20,22,23)/t16-;15-;14-;11-;11-,13+;11-,13-;2*10-,14+;11-,14+;11-,14-/m0000000000/s1
InChIKeyUIPFTVZKPQGAOX-KKQKXJNRSA-N
MW4248.20 g/mol
LogP34.37
Rot. Bonds55

About 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one

1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one (PubChem CID 161102344) has the molecular formula C211H234F5N53O20S10 and a molecular weight of 4248.20 g/mol. Its IUPAC name is 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one.

Molecular Properties

Compound Name1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one
PubChem CID161102344
Molecular FormulaC211H234F5N53O20S10
Molecular Weight4248.20 g/mol
Exact Mass4244.60
IUPAC Name1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one
SMILESCOCC1CN(C(=O)c2nc(N[C@@H](C)c3cccc(F)c3)nc3nc(C)sc23)C1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@@H](CO)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@H](CO)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3ccccc3)nc(C(=O)N3CC[C@@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3ccccc3)nc(C(=O)N3CC[C@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3ccccn3)nc(C(=O)N3CC(CC(=O)Cc4ccccc4)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CC(CC(=O)CC(C)(C)C)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CC(CC(=O)CC4CCCC4)C3)c2s1
InChIInChI=1S/C26H26N6O2S.C25H30N6O2S.C24H30N6O2S.3C20H22FN5O2S.2C19H20FN5O2S.2C19H21N5O2S/c1-16(21-10-6-7-11-27-21)28-26-30-22(23-24(31-26)29-17(2)35-23)25(34)32-14-19(15-32)13-20(33)12-18-8-4-3-5-9-18;1-15(19-8-5-9-26-12-19)27-25-29-21(22-23(30-25)28-16(2)34-22)24(33)31-13-18(14-31)11-20(32)10-17-6-3-4-7-17;1-14(17-7-6-8-25-11-17)26-23-28-19(20-21(29-23)27-15(2)33-20)22(32)30-12-16(13-30)9-18(31)10-24(3,4)5;1-11(14-5-4-6-15(21)7-14)22-20-24-16(17-18(25-20)23-12(2)29-17)19(27)26-8-13(9-26)10-28-3;2*1-11(14-4-3-5-15(21)8-14)22-20-24-16(17-18(25-20)23-12(2)29-17)19(28)26-7-6-13(9-26)10-27;2*1-10(12-4-3-5-13(20)8-12)21-19-23-15(16-17(24-19)22-11(2)28-16)18(27)25-7-6-14(26)9-25;2*1-11(13-6-4-3-5-7-13)20-19-22-15(16-17(23-19)21-12(2)27-16)18(26)24-9-8-14(25)10-24/h3-11,16,19H,12-15H2,1-2H3,(H,28,30,31);5,8-9,12,15,17-18H,3-4,6-7,10-11,13-14H2,1-2H3,(H,27,29,30);6-8,11,14,16H,9-10,12-13H2,1-5H3,(H,26,28,29);4-7,11,13H,8-10H2,1-3H3,(H,22,24,25);2*3-5,8,11,13,27H,6-7,9-10H2,1-2H3,(H,22,24,25);2*3-5,8,10,14,26H,6-7,9H2,1-2H3,(H,21,23,24);2*3-7,11,14,25H,8-10H2,1-2H3,(H,20,22,23)/t16-;15-;14-;11-;11-,13+;11-,13-;2*10-,14+;11-,14+;11-,14-/m0000000000/s1
InChIKeyUIPFTVZKPQGAOX-KKQKXJNRSA-N
XLogP34.37
TPSA930.59 Ų
H-Bond Donors16
H-Bond Acceptors73
Rotatable Bonds55
Heavy Atoms299
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004248.20
LogP ≤ 534.37
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1073

Analyze 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

azetidin-1-yl-[5-[1-(3-fluorophenyl)ethylamino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;azetidin-1-yl-[2-methyl-5-(1-pyridin-2-ylethylamino)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[5-[1-(3-fluorophenyl)ethylamino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-4-hydroxypentan-1-one;[5-[1-(3-fluorophenyl)ethylamino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-(3-hydroxypyrrolidin-1-yl)methanone;[5-[1-(3-fluorophenyl)ethylamino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-pyrrolidin-1-ylmethanone;[2-methyl-5-(1-phenylethylamino)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-pyrrolidin-1-ylmethanone
CID 159336754
[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone
CID 146418401
[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-(1-pyridin-2-ylethylamino)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone
CID 146418498
[5-[1-(5-fluoro-3-pyridinyl)ethylamino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 146427464
1-cyclopentyl-3-[1-[2-methyl-5-(1-pyridin-3-ylethylamino)-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]urea
CID 146418398
tert-butyl 2-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]acetate
CID 158377703
5-[[(1S)-1-(5-fluoro-3-pyridinyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidine-7-carboxylic acid;bis([5-[[(1S)-1-(5-fluoro-3-pyridinyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone);3-(methoxymethyl)azetidine
CID 158198362
1-[5-[1-(3-fluorophenyl)ethylamino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]-N,N-dimethylazetidine-3-carboxamide
CID 158764738
N-[1-[5-[1-(3-fluorophenyl)ethylamino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-N-methylacetamide
CID 157461109
(3-aminoazetidin-1-yl)-[5-[1-(5-fluoro-3-pyridinyl)ethylamino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone
CID 146418462
ethanamine;N-ethyl-1-[5-[[(1S)-1-(5-fluoro-3-pyridinyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]pyrrolidine-3-carboxamide;1-[5-[[(1S)-1-(5-fluoro-3-pyridinyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]pyrrolidine-3-carboxylic acid
CID 160529845
N-[1-[5-[1-(5-fluoro-3-pyridinyl)ethylamino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]cyclobutanecarboxamide
CID 146418413

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one?
The IUPAC name of 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one (CID 161102344) is 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one.
What is the SMILES notation for 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one?
The canonical SMILES for 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one is COCC1CN(C(=O)c2nc(N[C@@H](C)c3cccc(F)c3)nc3nc(C)sc23)C1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@@H](CO)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccc(F)c3)nc(C(=O)N3CC[C@H](CO)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3ccccc3)nc(C(=O)N3CC[C@@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3ccccc3)nc(C(=O)N3CC[C@H](O)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3ccccn3)nc(C(=O)N3CC(CC(=O)Cc4ccccc4)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CC(CC(=O)CC(C)(C)C)C3)c2s1.Cc1nc2nc(N[C@@H](C)c3cccnc3)nc(C(=O)N3CC(CC(=O)CC4CCCC4)C3)c2s1.
What is the InChIKey of 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one?
The InChIKey is UIPFTVZKPQGAOX-KKQKXJNRSA-N. The full InChI is InChI=1S/C26H26N6O2S.C25H30N6O2S.C24H30N6O2S.3C20H22FN5O2S.2C19H20FN5O2S.2C19H21N5O2S/c1-16(21-10-6-7-11-27-21)28-26-30-22(23-24(31-26)29-17(2)35-23)25(34)32-14-19(15-32)13-20(33)12-18-8-4-3-5-9-18;1-15(19-8-5-9-26-12-19)27-25-29-21(22-23(30-25)28-16(2)34-22)24(33)31-13-18(14-31)11-20(32)10-17-6-3-4-7-17;1-14(17-7-6-8-25-11-17)26-23-28-19(20-21(29-23)27-15(2)33-20)22(32)30-12-16(13-30)9-18(31)10-24(3,4)5;1-11(14-5-4-6-15(21)7-14)22-20-24-16(17-18(25-20)23-12(2)29-17)19(27)26-8-13(9-26)10-28-3;2*1-11(14-4-3-5-15(21)8-14)22-20-24-16(17-18(25-20)23-12(2)29-17)19(28)26-7-6-13(9-26)10-27;2*1-10(12-4-3-5-13(20)8-12)21-19-23-15(16-17(24-19)22-11(2)28-16)18(27)25-7-6-14(26)9-25;2*1-11(13-6-4-3-5-7-13)20-19-22-15(16-17(23-19)21-12(2)27-16)18(26)24-9-8-14(25)10-24/h3-11,16,19H,12-15H2,1-2H3,(H,28,30,31);5,8-9,12,15,17-18H,3-4,6-7,10-11,13-14H2,1-2H3,(H,27,29,30);6-8,11,14,16H,9-10,12-13H2,1-5H3,(H,26,28,29);4-7,11,13H,8-10H2,1-3H3,(H,22,24,25);2*3-5,8,11,13,27H,6-7,9-10H2,1-2H3,(H,22,24,25);2*3-5,8,10,14,26H,6-7,9H2,1-2H3,(H,21,23,24);2*3-7,11,14,25H,8-10H2,1-2H3,(H,20,22,23)/t16-;15-;14-;11-;11-,13+;11-,13-;2*10-,14+;11-,14+;11-,14-/m0000000000/s1.
What are the key properties of 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one?
1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one has a molecular weight of 4248.20 g/mol, XLogP of 34.37, 55 rotatable bonds, 16 hydrogen bond donors, and 73 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]propan-2-one;4,4-dimethyl-1-[1-[2-methyl-5-[[(1S)-1-pyridin-3-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]pentan-2-one;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3S)-3-(hydroxymethyl)pyrrolidin-1-yl]methanone;bis([5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone);[5-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-2-methyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]-[3-(methoxymethyl)azetidin-1-yl]methanone;[(3R)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;[(3S)-3-hydroxypyrrolidin-1-yl]-[2-methyl-5-[[(1S)-1-phenylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]methanone;1-[1-[2-methyl-5-[[(1S)-1-pyridin-2-ylethyl]amino]-[1,3]thiazolo[4,5-d]pyrimidine-7-carbonyl]azetidin-3-yl]-3-phenylpropan-2-one is sourced from PubChem (CID 161102344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).