11-(3-nitrophenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(3-nitrophenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(3-nitrophenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
Compound ID: | 3805-1426 |
Compound Name: | 11-(3-nitrophenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
Molecular Weight: | 419.48 |
Molecular Formula: | C24 H25 N3 O4 |
Smiles: | CCCCC(N1C(C2=C(CCCC2=O)Nc2ccccc12)c1cccc(c1)[N+]([O-])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.7493 |
logD: | 4.641 |
logSw: | -4.5537 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.29 |
InChI Key: | WQPFCOGITHCKJP-DEOSSOPVSA-N |