1-[4-(azepan-1-yl)-4-oxobutyl]-N,N-diethyl-1H-benzotriazole-5-sulfonamide
Chemical Structure Depiction of
1-[4-(azepan-1-yl)-4-oxobutyl]-N,N-diethyl-1H-benzotriazole-5-sulfonamide
1-[4-(azepan-1-yl)-4-oxobutyl]-N,N-diethyl-1H-benzotriazole-5-sulfonamide
Compound characteristics
| Compound ID: | F848-0505 |
| Compound Name: | 1-[4-(azepan-1-yl)-4-oxobutyl]-N,N-diethyl-1H-benzotriazole-5-sulfonamide |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C20 H31 N5 O3 S |
| Smiles: | CCN(CC)S(c1ccc2c(c1)nnn2CCCC(N1CCCCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9506 |
| logD: | 1.9506 |
| logSw: | -2.5346 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.463 |
| InChI Key: | BPUFKUHERYUTJC-UHFFFAOYSA-N |