1-ethyl-N-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-N-methyl-1H-benzotriazole-5-carboxamide
Chemical Structure Depiction of
1-ethyl-N-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-N-methyl-1H-benzotriazole-5-carboxamide
1-ethyl-N-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-N-methyl-1H-benzotriazole-5-carboxamide
Compound characteristics
| Compound ID: | F385-0533 |
| Compound Name: | 1-ethyl-N-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-N-methyl-1H-benzotriazole-5-carboxamide |
| Molecular Weight: | 369.4 |
| Molecular Formula: | C19 H20 F N5 O2 |
| Smiles: | CCn1c2ccc(cc2nn1)C(N(C)CC(NCc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1508 |
| logD: | 1.1508 |
| logSw: | -2.3743 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.283 |
| InChI Key: | NPTKDTDKRSNOPF-UHFFFAOYSA-N |