10-benzoyl-11-(4-chlorophenyl)-3-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-benzoyl-11-(4-chlorophenyl)-3-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-benzoyl-11-(4-chlorophenyl)-3-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 5236-0264 |
| Compound Name: | 10-benzoyl-11-(4-chlorophenyl)-3-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 494.98 |
| Molecular Formula: | C30 H23 Cl N2 O3 |
| Smiles: | C1C(CC(C2C(c3ccc(cc3)[Cl])N(C(c3ccccc3)=O)c3ccccc3NC1=2)=O)c1ccco1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.2798 |
| logD: | 6.2487 |
| logSw: | -6.4405 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.471 |
| InChI Key: | XMCUISIXYCDHFZ-UHFFFAOYSA-N |