5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane

C127H190BrCl3N26O29 — CID 158365413

IUPAC5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane
SMILESC1CCOC1.CC(C)(C)OC(=O)CCCBr.CC(C)(C)OC(=O)N(CCOc1c(Cl)ncnc1N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NCCOc1c(N)ncnc1Cl.Cc1cc(N)cc2c1C(=O)NC21CCCCC1.Cc1cc(Nc2ncnc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)c2OCCN(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc2c1C(=O)NC21CCCCC1.Cc1cc(Nc2ncnc(N)c2OCCN)cc2c1C(=O)NC21CCCCC1.N.Nc1ncnc(Cl)c1O
InChIInChI=1S/C40H58N6O10.C26H41ClN4O9.C20H26N6O2.C14H18N2O.C11H17ClN4O3.C8H15BrO2.C4H4ClN3O.C4H8O.H3N/c1-24-21-25(22-26-27(24)31(47)44-40(26)17-15-14-16-18-40)43-29-28(52-20-19-45(32(48)53-36(2,3)4)33(49)54-37(5,6)7)30(42-23-41-29)46(34(50)55-38(8,9)10)35(51)56-39(11,12)13;1-23(2,3)37-19(32)30(20(33)38-24(4,5)6)13-14-36-16-17(27)28-15-29-18(16)31(21(34)39-25(7,8)9)22(35)40-26(10,11)12;1-12-9-13(25-18-16(28-8-7-21)17(22)23-11-24-18)10-14-15(12)19(27)26-20(14)5-3-2-4-6-20;1-9-7-10(15)8-11-12(9)13(17)16-14(11)5-3-2-4-6-14;1-11(2,3)19-10(17)14-4-5-18-7-8(12)15-6-16-9(7)13;1-8(2,3)11-7(10)5-4-6-9;5-3-2(9)4(6)8-1-7-3;1-2-4-5-3-1;/h21-23H,14-20H2,1-13H3,(H,44,47)(H,41,42,43);15H,13-14H2,1-12H3;9-11H,2-8,21H2,1H3,(H,26,27)(H3,22,23,24,25);7-8H,2-6,15H2,1H3,(H,16,17);6H,4-5H2,1-3H3,(H,14,17)(H2,13,15,16);4-6H2,1-3H3;1,9H,(H2,6,7,8);1-4H2;1H3
InChIKeyWFXQVLHZOUOFPL-UHFFFAOYSA-N
MW2731.33 g/mol
LogP25.34
Rot. Bonds24

About 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane

5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane (PubChem CID 158365413) has the molecular formula C127H190BrCl3N26O29 and a molecular weight of 2731.33 g/mol. Its IUPAC name is 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane.

Molecular Properties

Compound Name5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane
PubChem CID158365413
Molecular FormulaC127H190BrCl3N26O29
Molecular Weight2731.33 g/mol
Exact Mass2727.24
IUPAC Name5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane
SMILESC1CCOC1.CC(C)(C)OC(=O)CCCBr.CC(C)(C)OC(=O)N(CCOc1c(Cl)ncnc1N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NCCOc1c(N)ncnc1Cl.Cc1cc(N)cc2c1C(=O)NC21CCCCC1.Cc1cc(Nc2ncnc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)c2OCCN(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc2c1C(=O)NC21CCCCC1.Cc1cc(Nc2ncnc(N)c2OCCN)cc2c1C(=O)NC21CCCCC1.N.Nc1ncnc(Cl)c1O
InChIInChI=1S/C40H58N6O10.C26H41ClN4O9.C20H26N6O2.C14H18N2O.C11H17ClN4O3.C8H15BrO2.C4H4ClN3O.C4H8O.H3N/c1-24-21-25(22-26-27(24)31(47)44-40(26)17-15-14-16-18-40)43-29-28(52-20-19-45(32(48)53-36(2,3)4)33(49)54-37(5,6)7)30(42-23-41-29)46(34(50)55-38(8,9)10)35(51)56-39(11,12)13;1-23(2,3)37-19(32)30(20(33)38-24(4,5)6)13-14-36-16-17(27)28-15-29-18(16)31(21(34)39-25(7,8)9)22(35)40-26(10,11)12;1-12-9-13(25-18-16(28-8-7-21)17(22)23-11-24-18)10-14-15(12)19(27)26-20(14)5-3-2-4-6-20;1-9-7-10(15)8-11-12(9)13(17)16-14(11)5-3-2-4-6-14;1-11(2,3)19-10(17)14-4-5-18-7-8(12)15-6-16-9(7)13;1-8(2,3)11-7(10)5-4-6-9;5-3-2(9)4(6)8-1-7-3;1-2-4-5-3-1;/h21-23H,14-20H2,1-13H3,(H,44,47)(H,41,42,43);15H,13-14H2,1-12H3;9-11H,2-8,21H2,1H3,(H,26,27)(H3,22,23,24,25);7-8H,2-6,15H2,1H3,(H,16,17);6H,4-5H2,1-3H3,(H,14,17)(H2,13,15,16);4-6H2,1-3H3;1,9H,(H2,6,7,8);1-4H2;1H3
InChIKeyWFXQVLHZOUOFPL-UHFFFAOYSA-N
XLogP25.34
TPSA759.73 Ų
H-Bond Donors13
H-Bond Acceptors47
Rotatable Bonds24
Heavy Atoms186
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002731.33
LogP ≤ 525.34
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1047

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane?
The IUPAC name of 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane (CID 158365413) is 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane.
What is the SMILES notation for 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane?
The canonical SMILES for 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane is C1CCOC1.CC(C)(C)OC(=O)CCCBr.CC(C)(C)OC(=O)N(CCOc1c(Cl)ncnc1N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)NCCOc1c(N)ncnc1Cl.Cc1cc(N)cc2c1C(=O)NC21CCCCC1.Cc1cc(Nc2ncnc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)c2OCCN(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc2c1C(=O)NC21CCCCC1.Cc1cc(Nc2ncnc(N)c2OCCN)cc2c1C(=O)NC21CCCCC1.N.Nc1ncnc(Cl)c1O.
What is the InChIKey of 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane?
The InChIKey is WFXQVLHZOUOFPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H58N6O10.C26H41ClN4O9.C20H26N6O2.C14H18N2O.C11H17ClN4O3.C8H15BrO2.C4H4ClN3O.C4H8O.H3N/c1-24-21-25(22-26-27(24)31(47)44-40(26)17-15-14-16-18-40)43-29-28(52-20-19-45(32(48)53-36(2,3)4)33(49)54-37(5,6)7)30(42-23-41-29)46(34(50)55-38(8,9)10)35(51)56-39(11,12)13;1-23(2,3)37-19(32)30(20(33)38-24(4,5)6)13-14-36-16-17(27)28-15-29-18(16)31(21(34)39-25(7,8)9)22(35)40-26(10,11)12;1-12-9-13(25-18-16(28-8-7-21)17(22)23-11-24-18)10-14-15(12)19(27)26-20(14)5-3-2-4-6-20;1-9-7-10(15)8-11-12(9)13(17)16-14(11)5-3-2-4-6-14;1-11(2,3)19-10(17)14-4-5-18-7-8(12)15-6-16-9(7)13;1-8(2,3)11-7(10)5-4-6-9;5-3-2(9)4(6)8-1-7-3;1-2-4-5-3-1;/h21-23H,14-20H2,1-13H3,(H,44,47)(H,41,42,43);15H,13-14H2,1-12H3;9-11H,2-8,21H2,1H3,(H,26,27)(H3,22,23,24,25);7-8H,2-6,15H2,1H3,(H,16,17);6H,4-5H2,1-3H3,(H,14,17)(H2,13,15,16);4-6H2,1-3H3;1,9H,(H2,6,7,8);1-4H2;1H3.
What are the key properties of 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane?
5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane has a molecular weight of 2731.33 g/mol, XLogP of 25.34, 24 rotatable bonds, 13 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[6-amino-5-(2-aminoethoxy)pyrimidin-4-yl]amino]-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;4-amino-6-chloropyrimidin-5-ol;5-amino-7-methylspiro[2H-isoindole-3,1'-cyclohexane]-1-one;azane;tert-butyl N-[2-(4-amino-6-chloropyrimidin-5-yl)oxyethyl]carbamate;tert-butyl N-[2-[4-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-chloropyrimidin-5-yl]oxyethyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[5-[2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]-6-[(7-methyl-1-oxospiro[2H-isoindole-3,1'-cyclohexane]-5-yl)amino]pyrimidin-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl 4-bromobutanoate;oxolane is sourced from PubChem (CID 158365413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).