2-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}-4-chlorophenyl methanesulfonate
Chemical Structure Depiction of
2-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}-4-chlorophenyl methanesulfonate
2-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}-4-chlorophenyl methanesulfonate
Compound characteristics
| Compound ID: | V026-7011 |
| Compound Name: | 2-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}-4-chlorophenyl methanesulfonate |
| Molecular Weight: | 388.91 |
| Molecular Formula: | C17 H25 Cl N2 O4 S |
| Smiles: | CC(C)(C)NC(N(CC1CC1)Cc1cc(ccc1OS(C)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7912 |
| logD: | 3.7912 |
| logSw: | -4.2866 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.175 |
| InChI Key: | VHTZKEUTWRPMRH-UHFFFAOYSA-N |