1-{2-[(4-bromo-2-fluorophenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-{2-[(4-bromo-2-fluorophenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-carboxamide
1-{2-[(4-bromo-2-fluorophenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L693-0275 |
| Compound Name: | 1-{2-[(4-bromo-2-fluorophenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 449.28 |
| Molecular Formula: | C18 H18 Br F N6 O2 |
| Smiles: | CN(C)C(c1ccc2c(c1)nnn2CCNC(Nc1ccc(cc1F)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5253 |
| logD: | 1.5241 |
| logSw: | -2.2195 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.684 |
| InChI Key: | QFUJIMOGMNXIKH-UHFFFAOYSA-N |