10-(4-chlorobenzoyl)-11-(furan-2-yl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-(4-chlorobenzoyl)-11-(furan-2-yl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-(4-chlorobenzoyl)-11-(furan-2-yl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 8017-2034 |
| Compound Name: | 10-(4-chlorobenzoyl)-11-(furan-2-yl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 432.91 |
| Molecular Formula: | C25 H21 Cl N2 O3 |
| Smiles: | CC1CC2=C(C(c3ccco3)N(C(c3ccc(cc3)[Cl])=O)c3ccccc3N2)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3626 |
| logD: | 5.3334 |
| logSw: | -6.0156 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.743 |
| InChI Key: | KDUKQIGZEHYLQG-UHFFFAOYSA-N |