N,N-dimethyl-1-{2-[(3,4,5-trimethoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
Chemical Structure Depiction of
N,N-dimethyl-1-{2-[(3,4,5-trimethoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
N,N-dimethyl-1-{2-[(3,4,5-trimethoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide
Compound characteristics
| Compound ID: | G373-2018 |
| Compound Name: | N,N-dimethyl-1-{2-[(3,4,5-trimethoxyphenyl)carbamamido]ethyl}-1H-benzotriazole-5-sulfonamide |
| Molecular Weight: | 478.53 |
| Molecular Formula: | C20 H26 N6 O6 S |
| Smiles: | CN(C)S(c1ccc2c(c1)nnn2CCNC(Nc1cc(c(c(c1)OC)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0807 |
| logD: | 1.0806 |
| logSw: | -2.4917 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 116.023 |
| InChI Key: | SMUOFOPEOBLDDU-UHFFFAOYSA-N |