1-[(4-bromophenyl)methyl]-7,8-dimethyl-4-(thiophen-2-yl)-1,3-dihydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
1-[(4-bromophenyl)methyl]-7,8-dimethyl-4-(thiophen-2-yl)-1,3-dihydro-2H-1,5-benzodiazepin-2-one
1-[(4-bromophenyl)methyl]-7,8-dimethyl-4-(thiophen-2-yl)-1,3-dihydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | F402-0558 |
| Compound Name: | 1-[(4-bromophenyl)methyl]-7,8-dimethyl-4-(thiophen-2-yl)-1,3-dihydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 439.37 |
| Molecular Formula: | C22 H19 Br N2 O S |
| Smiles: | Cc1cc2c(cc1C)N(Cc1ccc(cc1)[Br])C(CC(c1cccs1)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2531 |
| logD: | 6.2531 |
| logSw: | -5.45 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.6083 |
| InChI Key: | AUKXHCCDRCWSST-UHFFFAOYSA-N |