N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[5-(piperidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[5-(piperidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[5-(piperidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide
Compound characteristics
| Compound ID: | F514-0242 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[5-(piperidine-1-sulfonyl)-1H-benzotriazol-1-yl]propanamide |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C22 H31 N5 O3 S |
| Smiles: | C1CCN(CC1)S(c1ccc2c(c1)nnn2CCC(NCCC1CCCCC=1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2874 |
| logD: | 2.2874 |
| logSw: | -2.8681 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.859 |
| InChI Key: | KHSWPSOGKVDXSQ-UHFFFAOYSA-N |