1-[4-(pyridin-2-yl)piperazin-1-yl]-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propan-1-one
Chemical Structure Depiction of
1-[4-(pyridin-2-yl)piperazin-1-yl]-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propan-1-one
1-[4-(pyridin-2-yl)piperazin-1-yl]-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propan-1-one
Compound characteristics
| Compound ID: | F514-0090 |
| Compound Name: | 1-[4-(pyridin-2-yl)piperazin-1-yl]-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propan-1-one |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C22 H27 N7 O3 S |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)nnn2CCC(N1CCN(CC1)c1ccccn1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5607 |
| logD: | 1.5518 |
| logSw: | -2.3534 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 85.884 |
| InChI Key: | VENDMTDHAMWYKZ-UHFFFAOYSA-N |