1-{2-[(5-chloro-2-methoxyphenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide
Chemical Structure Depiction of
1-{2-[(5-chloro-2-methoxyphenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide
1-{2-[(5-chloro-2-methoxyphenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide
Compound characteristics
| Compound ID: | L447-0178 |
| Compound Name: | 1-{2-[(5-chloro-2-methoxyphenyl)carbamamido]ethyl}-N,N-dimethyl-1H-benzotriazole-5-sulfonamide |
| Molecular Weight: | 452.92 |
| Molecular Formula: | C18 H21 Cl N6 O4 S |
| Smiles: | CN(C)S(c1ccc2c(c1)nnn2CCNC(Nc1cc(ccc1OC)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9539 |
| logD: | 1.9534 |
| logSw: | -3.0546 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.977 |
| InChI Key: | ADBNTLDDKPACGS-UHFFFAOYSA-N |