5-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
5-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-1135 |
| Compound Name: | 5-{[tert-butyl-N-(2-methoxyethyl)carbamamido]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 507.61 |
| Molecular Formula: | C24 H33 N3 O7 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1cc(CN(CCOC)C(NC(C)(C)C)=O)ccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5264 |
| logD: | 2.5262 |
| logSw: | -3.0727 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.749 |
| InChI Key: | AMQQWLJQMDCDAW-UHFFFAOYSA-N |