1-[(4-bromophenyl)methyl]-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
1-[(4-bromophenyl)methyl]-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
1-[(4-bromophenyl)methyl]-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | D428-0126 |
| Compound Name: | 1-[(4-bromophenyl)methyl]-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 345.24 |
| Molecular Formula: | C17 H17 Br N2 O |
| Smiles: | CC1CC(N(Cc2ccc(cc2)[Br])c2ccccc2N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2576 |
| logD: | 4.2575 |
| logSw: | -4.1893 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.4378 |
| InChI Key: | HNGGXBRVFPRDAH-GFCCVEGCSA-N |