10-[(1H-benzimidazol-2-yl)methyl]-11-(4-tert-butylphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-[(1H-benzimidazol-2-yl)methyl]-11-(4-tert-butylphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-[(1H-benzimidazol-2-yl)methyl]-11-(4-tert-butylphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 6208-0364 |
| Compound Name: | 10-[(1H-benzimidazol-2-yl)methyl]-11-(4-tert-butylphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 504.68 |
| Molecular Formula: | C33 H36 N4 O |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)C(C)(C)C)N(Cc3nc4ccccc4[nH]3)c3ccccc3N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.7782 |
| logD: | 7.7583 |
| logSw: | -5.8032 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.862 |
| InChI Key: | GVTWCYXIFIPVMM-HKBQPEDESA-N |