N-(2,4-dimethylphenyl)-2-[2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-2-[2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide
N-(2,4-dimethylphenyl)-2-[2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide
Compound characteristics
| Compound ID: | F402-0006 |
| Compound Name: | N-(2,4-dimethylphenyl)-2-[2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C23 H21 N3 O2 S |
| Smiles: | Cc1ccc(c(C)c1)NC(CN1C(CC(c2cccs2)=Nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3703 |
| logD: | 4.3703 |
| logSw: | -4.3095 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.06 |
| InChI Key: | ROUQBUVKSYIPCN-UHFFFAOYSA-N |