N-cycloheptyl-4-[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-cycloheptyl-4-[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)methyl]benzamide
N-cycloheptyl-4-[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)methyl]benzamide
Compound characteristics
Compound ID: | L610-0068 |
Compound Name: | N-cycloheptyl-4-[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)methyl]benzamide |
Molecular Weight: | 445.56 |
Molecular Formula: | C27 H31 N3 O3 |
Smiles: | C1CCCC(CC1)NC(c1ccc(CN2C(C3CCCN3C(c3ccccc23)=O)=O)cc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.4663 |
logD: | 3.4663 |
logSw: | -3.8268 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.743 |
InChI Key: | ZQTXLHLPEFQZIC-DEOSSOPVSA-N |