5-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
5-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
Compound ID: | V031-2052 |
Compound Name: | 5-{[tert-butyl-N-(cyclopropylmethyl)carbamamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate |
Molecular Weight: | 476.59 |
Molecular Formula: | C24 H32 N2 O6 S |
Smiles: | CC(C)(C)NC(N(CC1CC1)Cc1ccc(c(c1)OS(c1ccc(cc1)OC)(=O)=O)OC)=O |
Stereo: | ACHIRAL |
logP: | 4.3291 |
logD: | 4.329 |
logSw: | -4.3774 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.962 |
InChI Key: | SPZDATUVIKCFBT-UHFFFAOYSA-N |