1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile

C123H146F2N24O10S6 — CID 160912851

IUPAC1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile
SMILESC.CC(C)[C@H](CO)Nc1nc(N2CCC(C3=NCC(c4cccs4)=C3)CC2)nc2c1S(=O)CC2.Cc1ccc(C2(C#N)CCN(c3nc4c(c(NC5CCOCC5)n3)S(=O)CC4)CC2)cc1.Cc1ccc(C2(C#N)CCN(c3nc4c(c(N[C@H]5CCC(=O)N(C)C5)n3)S(=O)CC4)CC2)cc1.Cc1ccc(C2(CO)CCN(c3nc4c(c(Nc5cccc(F)c5)n3)S(=O)CC4)CC2)cc1.Cc1ccc(C2(O)CCN(c3nc4c(c(Nc5cccc(F)c5)n3)S(=O)CC4)CC2)cc1
InChIInChI=1S/C25H27FN4O2S.C25H30N6O2S.C24H25FN4O2S.C24H31N5O2S2.C24H29N5O2S.CH4/c1-17-5-7-18(8-6-17)25(16-31)10-12-30(13-11-25)24-28-21-9-14-33(32)22(21)23(29-24)27-20-4-2-3-19(26)15-20;1-17-3-5-18(6-4-17)25(16-26)10-12-31(13-11-25)24-28-20-9-14-34(33)22(20)23(29-24)27-19-7-8-21(32)30(2)15-19;1-16-5-7-17(8-6-16)24(30)10-12-29(13-11-24)23-27-20-9-14-32(31)21(20)22(28-23)26-19-4-2-3-18(25)15-19;1-15(2)20(14-30)26-23-22-18(7-11-33(22)31)27-24(28-23)29-8-5-16(6-9-29)19-12-17(13-25-19)21-4-3-10-32-21;1-17-2-4-18(5-3-17)24(16-25)9-11-29(12-10-24)23-27-20-8-15-32(30)21(20)22(28-23)26-19-6-13-31-14-7-19;/h2-8,15,31H,9-14,16H2,1H3,(H,27,28,29);3-6,19H,7-15H2,1-2H3,(H,27,28,29);2-8,15,30H,9-14H2,1H3,(H,26,27,28);3-4,10,12,15-16,20,30H,5-9,11,13-14H2,1-2H3,(H,26,27,28);2-5,19H,6-15H2,1H3,(H,26,27,28);1H4/t;19-,34?;;20-,33?;;/m.0.0../s1
InChIKeySRAAAHLDPCUGGP-QHKNLNTLSA-N
MW2351.08 g/mol
LogP17.35
Rot. Bonds24

About 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile

1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile (PubChem CID 160912851) has the molecular formula C123H146F2N24O10S6 and a molecular weight of 2351.08 g/mol. Its IUPAC name is 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile.

Molecular Properties

Compound Name1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile
PubChem CID160912851
Molecular FormulaC123H146F2N24O10S6
Molecular Weight2351.08 g/mol
Exact Mass2348.99
IUPAC Name1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile
SMILESC.CC(C)[C@H](CO)Nc1nc(N2CCC(C3=NCC(c4cccs4)=C3)CC2)nc2c1S(=O)CC2.Cc1ccc(C2(C#N)CCN(c3nc4c(c(NC5CCOCC5)n3)S(=O)CC4)CC2)cc1.Cc1ccc(C2(C#N)CCN(c3nc4c(c(N[C@H]5CCC(=O)N(C)C5)n3)S(=O)CC4)CC2)cc1.Cc1ccc(C2(CO)CCN(c3nc4c(c(Nc5cccc(F)c5)n3)S(=O)CC4)CC2)cc1.Cc1ccc(C2(O)CCN(c3nc4c(c(Nc5cccc(F)c5)n3)S(=O)CC4)CC2)cc1
InChIInChI=1S/C25H27FN4O2S.C25H30N6O2S.C24H25FN4O2S.C24H31N5O2S2.C24H29N5O2S.CH4/c1-17-5-7-18(8-6-17)25(16-31)10-12-30(13-11-25)24-28-21-9-14-33(32)22(21)23(29-24)27-20-4-2-3-19(26)15-20;1-17-3-5-18(6-4-17)25(16-26)10-12-31(13-11-25)24-28-20-9-14-34(33)22(20)23(29-24)27-19-7-8-21(32)30(2)15-19;1-16-5-7-17(8-6-16)24(30)10-12-29(13-11-24)23-27-20-9-14-32(31)21(20)22(28-23)26-19-4-2-3-18(25)15-19;1-15(2)20(14-30)26-23-22-18(7-11-33(22)31)27-24(28-23)29-8-5-16(6-9-29)19-12-17(13-25-19)21-4-3-10-32-21;1-17-2-4-18(5-3-17)24(16-25)9-11-29(12-10-24)23-27-20-8-15-32(30)21(20)22(28-23)26-19-6-13-31-14-7-19;/h2-8,15,31H,9-14,16H2,1H3,(H,27,28,29);3-6,19H,7-15H2,1-2H3,(H,27,28,29);2-8,15,30H,9-14H2,1H3,(H,26,27,28);3-4,10,12,15-16,20,30H,5-9,11,13-14H2,1-2H3,(H,26,27,28);2-5,19H,6-15H2,1H3,(H,26,27,28);1H4/t;19-,34?;;20-,33?;;/m.0.0../s1
InChIKeySRAAAHLDPCUGGP-QHKNLNTLSA-N
XLogP17.35
TPSA440.77 Ų
H-Bond Donors8
H-Bond Acceptors34
Rotatable Bonds24
Heavy Atoms165
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002351.08
LogP ≤ 517.35
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1034

Analyze 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile?
The IUPAC name of 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile (CID 160912851) is 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile.
What is the SMILES notation for 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile?
The canonical SMILES for 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile is C.CC(C)[C@H](CO)Nc1nc(N2CCC(C3=NCC(c4cccs4)=C3)CC2)nc2c1S(=O)CC2.Cc1ccc(C2(C#N)CCN(c3nc4c(c(NC5CCOCC5)n3)S(=O)CC4)CC2)cc1.Cc1ccc(C2(C#N)CCN(c3nc4c(c(N[C@H]5CCC(=O)N(C)C5)n3)S(=O)CC4)CC2)cc1.Cc1ccc(C2(CO)CCN(c3nc4c(c(Nc5cccc(F)c5)n3)S(=O)CC4)CC2)cc1.Cc1ccc(C2(O)CCN(c3nc4c(c(Nc5cccc(F)c5)n3)S(=O)CC4)CC2)cc1.
What is the InChIKey of 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile?
The InChIKey is SRAAAHLDPCUGGP-QHKNLNTLSA-N. The full InChI is InChI=1S/C25H27FN4O2S.C25H30N6O2S.C24H25FN4O2S.C24H31N5O2S2.C24H29N5O2S.CH4/c1-17-5-7-18(8-6-17)25(16-31)10-12-30(13-11-25)24-28-21-9-14-33(32)22(21)23(29-24)27-20-4-2-3-19(26)15-20;1-17-3-5-18(6-4-17)25(16-26)10-12-31(13-11-25)24-28-20-9-14-34(33)22(20)23(29-24)27-19-7-8-21(32)30(2)15-19;1-16-5-7-17(8-6-16)24(30)10-12-29(13-11-24)23-27-20-9-14-32(31)21(20)22(28-23)26-19-4-2-3-18(25)15-19;1-15(2)20(14-30)26-23-22-18(7-11-33(22)31)27-24(28-23)29-8-5-16(6-9-29)19-12-17(13-25-19)21-4-3-10-32-21;1-17-2-4-18(5-3-17)24(16-25)9-11-29(12-10-24)23-27-20-8-15-32(30)21(20)22(28-23)26-19-6-13-31-14-7-19;/h2-8,15,31H,9-14,16H2,1H3,(H,27,28,29);3-6,19H,7-15H2,1-2H3,(H,27,28,29);2-8,15,30H,9-14H2,1H3,(H,26,27,28);3-4,10,12,15-16,20,30H,5-9,11,13-14H2,1-2H3,(H,26,27,28);2-5,19H,6-15H2,1H3,(H,26,27,28);1H4/t;19-,34?;;20-,33?;;/m.0.0../s1.
What are the key properties of 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile?
1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile has a molecular weight of 2351.08 g/mol, XLogP of 17.35, 24 rotatable bonds, 8 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-ol;[1-[4-(3-fluoroanilino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidin-4-yl]methanol;methane;1-[4-[[(3S)-1-methyl-6-oxopiperidin-3-yl]amino]-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]-4-(4-methylphenyl)piperidine-4-carbonitrile;(2R)-3-methyl-2-[[5-oxo-2-[4-(3-thiophen-2-yl-2H-pyrrol-5-yl)piperidin-1-yl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl]amino]butan-1-ol;4-(4-methylphenyl)-1-[4-(oxan-4-ylamino)-5-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carbonitrile is sourced from PubChem (CID 160912851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).