2-methoxy-5-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
2-methoxy-5-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-0425 |
| Compound Name: | 2-methoxy-5-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 493.58 |
| Molecular Formula: | C23 H31 N3 O7 S |
| Smiles: | CC(C)NC(N(CCOC)Cc1ccc(c(c1)OS(c1ccc(cc1)NC(C)=O)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0786 |
| logD: | 2.0785 |
| logSw: | -3.0398 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.899 |
| InChI Key: | YINXWOZZLAMXKM-UHFFFAOYSA-N |