N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide

C119H149N25O13 — CID 158118902

IUPACN-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide
SMILESCOc1cc(C(=O)NC2CCC(O)CC2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C.COc1cc(C(=O)NCCc2ccccc2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C.COc1cc(C(=O)NCc2ccccc2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C.COc1cc(C(=O)NCc2cccnc2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C
InChIInChI=1S/C31H38N6O3.C30H36N6O3.C29H35N7O3.C29H40N6O4/c1-31(2)20-37(23-12-8-9-13-23)27-25(36(3)29(31)39)19-33-30(35-27)34-24-15-14-22(18-26(24)40-4)28(38)32-17-16-21-10-6-5-7-11-21;1-30(2)19-36(22-12-8-9-13-22)26-24(35(3)28(30)38)18-32-29(34-26)33-23-15-14-21(16-25(23)39-4)27(37)31-17-20-10-6-5-7-11-20;1-29(2)18-36(21-9-5-6-10-21)25-23(35(3)27(29)38)17-32-28(34-25)33-22-12-11-20(14-24(22)39-4)26(37)31-16-19-8-7-13-30-15-19;1-29(2)17-35(20-7-5-6-8-20)25-23(34(3)27(29)38)16-30-28(33-25)32-22-14-9-18(15-24(22)39-4)26(37)31-19-10-12-21(36)13-11-19/h5-7,10-11,14-15,18-19,23H,8-9,12-13,16-17,20H2,1-4H3,(H,32,38)(H,33,34,35);5-7,10-11,14-16,18,22H,8-9,12-13,17,19H2,1-4H3,(H,31,37)(H,32,33,34);7-8,11-15,17,21H,5-6,9-10,16,18H2,1-4H3,(H,31,37)(H,32,33,34);9,14-16,19-21,36H,5-8,10-13,17H2,1-4H3,(H,31,37)(H,30,32,33)
InChIKeyFRJBAWKIFICATA-UHFFFAOYSA-N
MW2137.66 g/mol
LogP18.18
Rot. Bonds28

About N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide

N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 158118902) has the molecular formula C119H149N25O13 and a molecular weight of 2137.66 g/mol. Its IUPAC name is N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound NameN-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide
PubChem CID158118902
Molecular FormulaC119H149N25O13
Molecular Weight2137.66 g/mol
Exact Mass2136.18
IUPAC NameN-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide
SMILESCOc1cc(C(=O)NC2CCC(O)CC2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C.COc1cc(C(=O)NCCc2ccccc2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C.COc1cc(C(=O)NCc2ccccc2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C.COc1cc(C(=O)NCc2cccnc2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C
InChIInChI=1S/C31H38N6O3.C30H36N6O3.C29H35N7O3.C29H40N6O4/c1-31(2)20-37(23-12-8-9-13-23)27-25(36(3)29(31)39)19-33-30(35-27)34-24-15-14-22(18-26(24)40-4)28(38)32-17-16-21-10-6-5-7-11-21;1-30(2)19-36(22-12-8-9-13-22)26-24(35(3)28(30)38)18-32-29(34-26)33-23-15-14-21(16-25(23)39-4)27(37)31-17-20-10-6-5-7-11-20;1-29(2)18-36(21-9-5-6-10-21)25-23(35(3)27(29)38)17-32-28(34-25)33-22-12-11-20(14-24(22)39-4)26(37)31-16-19-8-7-13-30-15-19;1-29(2)17-35(20-7-5-6-8-20)25-23(34(3)27(29)38)16-30-28(33-25)32-22-14-9-18(15-24(22)39-4)26(37)31-19-10-12-21(36)13-11-19/h5-7,10-11,14-15,18-19,23H,8-9,12-13,16-17,20H2,1-4H3,(H,32,38)(H,33,34,35);5-7,10-11,14-16,18,22H,8-9,12-13,17,19H2,1-4H3,(H,31,37)(H,32,33,34);7-8,11-15,17,21H,5-6,9-10,16,18H2,1-4H3,(H,31,37)(H,32,33,34);9,14-16,19-21,36H,5-8,10-13,17H2,1-4H3,(H,31,37)(H,30,32,33)
InChIKeyFRJBAWKIFICATA-UHFFFAOYSA-N
XLogP18.18
TPSA431.88 Ų
H-Bond Donors9
H-Bond Acceptors30
Rotatable Bonds28
Heavy Atoms157
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002137.66
LogP ≤ 518.18
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1030

Analyze N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide with MolForge

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Launch Full Analysis

Related Compounds

4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(3-hydroxycyclopentyl)-3-methoxybenzamide
CID 76653312
4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(2-hydroxypropyl)-3-methoxybenzamide
CID 67392142
4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-methoxy-2-methylpropyl)benzamide
CID 118873106
4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(2,2-difluoropropyl)-3-methoxybenzamide
CID 118873107
4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(1-methyl-4H-pyridin-4-yl)benzamide
CID 25124328
4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(3-hydroxy-2-nitrosopropyl)-3-methoxybenzamide
CID 163604096
4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;cyclopropylbenzene
CID 143527323
2-[[4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzoyl]amino]ethyl (3R)-3-methylpyrrolidine-1-carboxylate
CID 70933084
N-(azetidin-3-yl)-4-[(9-cyclohexyl-7,7-difluoro-5-methyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide
CID 25254000
4-[(9-cyclohexyl-7,7-difluoro-5-methyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(1-methylpiperidin-4-yl)benzamide
CID 25253837
N-cyclopentyl-4-[[(7S)-9-cyclopentyl-5,7-dimethyl-6-oxo-7,8-dihydropyrimido[4,5-b][1,4]diazepin-2-yl]amino]-3-methoxybenzamide;4-[[(7S)-9-cyclopentyl-5,7-dimethyl-6-oxo-7,8-dihydropyrimido[4,5-b][1,4]diazepin-2-yl]amino]-N-cyclopropyl-3-methoxybenzamide;4-[[(7S)-9-cyclopentyl-5,7-dimethyl-6-oxo-7,8-dihydropyrimido[4,5-b][1,4]diazepin-2-yl]amino]-3-methoxy-N-(oxan-4-yl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-[(3S)-oxolan-3-yl]benzamide
CID 161089747
CID 174041610
CID 174041610

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide (CID 158118902) is N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide is COc1cc(C(=O)NC2CCC(O)CC2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C.COc1cc(C(=O)NCCc2ccccc2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C.COc1cc(C(=O)NCc2ccccc2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C.COc1cc(C(=O)NCc2cccnc2)ccc1Nc1ncc2c(n1)N(C1CCCC1)CC(C)(C)C(=O)N2C.
What is the InChIKey of N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is FRJBAWKIFICATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H38N6O3.C30H36N6O3.C29H35N7O3.C29H40N6O4/c1-31(2)20-37(23-12-8-9-13-23)27-25(36(3)29(31)39)19-33-30(35-27)34-24-15-14-22(18-26(24)40-4)28(38)32-17-16-21-10-6-5-7-11-21;1-30(2)19-36(22-12-8-9-13-22)26-24(35(3)28(30)38)18-32-29(34-26)33-23-15-14-21(16-25(23)39-4)27(37)31-17-20-10-6-5-7-11-20;1-29(2)18-36(21-9-5-6-10-21)25-23(35(3)27(29)38)17-32-28(34-25)33-22-12-11-20(14-24(22)39-4)26(37)31-16-19-8-7-13-30-15-19;1-29(2)17-35(20-7-5-6-8-20)25-23(34(3)27(29)38)16-30-28(33-25)32-22-14-9-18(15-24(22)39-4)26(37)31-19-10-12-21(36)13-11-19/h5-7,10-11,14-15,18-19,23H,8-9,12-13,16-17,20H2,1-4H3,(H,32,38)(H,33,34,35);5-7,10-11,14-16,18,22H,8-9,12-13,17,19H2,1-4H3,(H,31,37)(H,32,33,34);7-8,11-15,17,21H,5-6,9-10,16,18H2,1-4H3,(H,31,37)(H,32,33,34);9,14-16,19-21,36H,5-8,10-13,17H2,1-4H3,(H,31,37)(H,30,32,33).
What are the key properties of N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide?
N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide has a molecular weight of 2137.66 g/mol, XLogP of 18.18, 28 rotatable bonds, 9 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-N-(4-hydroxycyclohexyl)-3-methoxybenzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(2-phenylethyl)benzamide;4-[(9-cyclopentyl-5,7,7-trimethyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-3-methoxy-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 158118902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).