N-[(4-fluorophenyl)methyl]-N'-{2-[5-(pyrrolidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}urea
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-N'-{2-[5-(pyrrolidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}urea
N-[(4-fluorophenyl)methyl]-N'-{2-[5-(pyrrolidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}urea
Compound characteristics
| Compound ID: | L693-0065 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-N'-{2-[5-(pyrrolidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}urea |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C21 H23 F N6 O2 |
| Smiles: | C1CCN(C1)C(c1ccc2c(c1)nnn2CCNC(NCc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1497 |
| logD: | 1.1497 |
| logSw: | -2.0587 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.717 |
| InChI Key: | RSOFASRMJZYCEC-UHFFFAOYSA-N |