N,N-diethyl-1-{2-[(4-methoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
Chemical Structure Depiction of
N,N-diethyl-1-{2-[(4-methoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
N,N-diethyl-1-{2-[(4-methoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
Compound characteristics
| Compound ID: | L447-0246 |
| Compound Name: | N,N-diethyl-1-{2-[(4-methoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide |
| Molecular Weight: | 446.53 |
| Molecular Formula: | C20 H26 N6 O4 S |
| Smiles: | CCN(CC)S(c1ccc2c(c1)nnn2CCNC(Nc1ccc(cc1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.269 |
| logD: | 2.269 |
| logSw: | -3.1 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.021 |
| InChI Key: | SPUUOBXXOVMDSW-UHFFFAOYSA-N |