N-(prop-2-en-1-yl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
Chemical Structure Depiction of
N-(prop-2-en-1-yl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
N-(prop-2-en-1-yl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
Compound characteristics
| Compound ID: | F514-0105 |
| Compound Name: | N-(prop-2-en-1-yl)-3-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C16 H21 N5 O3 S |
| Smiles: | C=CCNC(CCn1c2ccc(cc2nn1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5463 |
| logD: | 0.5463 |
| logSw: | -2.3852 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.304 |
| InChI Key: | JCYWDDPQTJQTFU-UHFFFAOYSA-N |