N-(3-phenylpropyl)-4-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]butanamide
Chemical Structure Depiction of
N-(3-phenylpropyl)-4-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]butanamide
N-(3-phenylpropyl)-4-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]butanamide
Compound characteristics
| Compound ID: | F848-0048 |
| Compound Name: | N-(3-phenylpropyl)-4-[5-(pyrrolidine-1-sulfonyl)-1H-benzotriazol-1-yl]butanamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C23 H29 N5 O3 S |
| Smiles: | C(Cc1ccccc1)CNC(CCCn1c2ccc(cc2nn1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.343 |
| logD: | 2.343 |
| logSw: | -2.9554 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.033 |
| InChI Key: | WMQNVFVIUQYGCS-UHFFFAOYSA-N |