11-(4-methylphenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(4-methylphenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(4-methylphenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
Compound ID: | 3805-1436 |
Compound Name: | 11-(4-methylphenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
Molecular Weight: | 388.51 |
Molecular Formula: | C25 H28 N2 O2 |
Smiles: | CCCCC(N1C(C2=C(CCCC2=O)Nc2ccccc12)c1ccc(C)cc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.3003 |
logD: | 5.192 |
logSw: | -5.2003 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 38.909 |
InChI Key: | XKARAJRSGYUTGF-VWLOTQADSA-N |