2-[(4-bromophenyl)(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-(4-cyclohexylphenyl)ethan-1-one--hydrogen bromide (1/1)
Chemical Structure Depiction of
2-[(4-bromophenyl)(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-(4-cyclohexylphenyl)ethan-1-one--hydrogen bromide (1/1)
2-[(4-bromophenyl)(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-(4-cyclohexylphenyl)ethan-1-one--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8012-9639 |
| Compound Name: | 2-[(4-bromophenyl)(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-(4-cyclohexylphenyl)ethan-1-one--hydrogen bromide (1/1) |
| Molecular Weight: | 548.36 |
| Molecular Formula: | C26 H31 Br N2 O |
| Salt: | HBr |
| Smiles: | C1CCC(CC1)c1ccc(cc1)C(CN(C1CCCCCN=1)c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 7.2329 |
| logD: | 4.0972 |
| logSw: | -5.9651 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.0719 |
| InChI Key: | RYCNHUAFJJJJDD-UHFFFAOYSA-N |