1-(2-{[(4-fluorophenyl)methyl]carbamamido}ethyl)-N,N-dimethyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-(2-{[(4-fluorophenyl)methyl]carbamamido}ethyl)-N,N-dimethyl-1H-benzotriazole-5-carboxamide
1-(2-{[(4-fluorophenyl)methyl]carbamamido}ethyl)-N,N-dimethyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | L693-0308 |
| Compound Name: | 1-(2-{[(4-fluorophenyl)methyl]carbamamido}ethyl)-N,N-dimethyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 384.41 |
| Molecular Formula: | C19 H21 F N6 O2 |
| Smiles: | CN(C)C(c1ccc2c(c1)nnn2CCNC(NCc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1216 |
| logD: | 0.1216 |
| logSw: | -1.9108 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.704 |
| InChI Key: | VNAGYZCMGLEGGN-UHFFFAOYSA-N |