1-{2-[(4-bromo-2-fluorophenyl)carbamamido]ethyl}-N,N-diethyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-{2-[(4-bromo-2-fluorophenyl)carbamamido]ethyl}-N,N-diethyl-1H-benzotriazole-5-carboxamide
1-{2-[(4-bromo-2-fluorophenyl)carbamamido]ethyl}-N,N-diethyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L693-0365 |
| Compound Name: | 1-{2-[(4-bromo-2-fluorophenyl)carbamamido]ethyl}-N,N-diethyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 477.33 |
| Molecular Formula: | C20 H22 Br F N6 O2 |
| Smiles: | CCN(CC)C(c1ccc2c(c1)nnn2CCNC(Nc1ccc(cc1F)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4914 |
| logD: | 2.4902 |
| logSw: | -3.0807 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.615 |
| InChI Key: | MEMWOKWFMBHNII-UHFFFAOYSA-N |