10-butanoyl-11-(2,6-dichlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-butanoyl-11-(2,6-dichlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-butanoyl-11-(2,6-dichlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 3805-1374 |
| Compound Name: | 10-butanoyl-11-(2,6-dichlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 429.34 |
| Molecular Formula: | C23 H22 Cl2 N2 O2 |
| Smiles: | CCCC(N1C(C2=C(CCCC2=O)Nc2ccccc12)c1c(cccc1[Cl])[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0835 |
| logD: | 5.0291 |
| logSw: | -5.3145 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.909 |
| InChI Key: | NAUAFWKKQMTFAE-QHCPKHFHSA-N |