2-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
2-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-7482 |
| Compound Name: | 2-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 446.56 |
| Molecular Formula: | C23 H30 N2 O5 S |
| Smiles: | CC(C)(C)NC(N(CC1CC1)Cc1ccccc1OS(c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8298 |
| logD: | 4.8298 |
| logSw: | -4.5586 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.331 |
| InChI Key: | ZAXURMSJNVJUFR-UHFFFAOYSA-N |