3-butyl-2-(butylimino)-N-(3-ethoxyphenyl)-4-oxo-1,3-thiazinane-6-carboxamide
Chemical Structure Depiction of
3-butyl-2-(butylimino)-N-(3-ethoxyphenyl)-4-oxo-1,3-thiazinane-6-carboxamide
3-butyl-2-(butylimino)-N-(3-ethoxyphenyl)-4-oxo-1,3-thiazinane-6-carboxamide
Compound characteristics
Compound ID: | Y510-5228 |
Compound Name: | 3-butyl-2-(butylimino)-N-(3-ethoxyphenyl)-4-oxo-1,3-thiazinane-6-carboxamide |
Molecular Weight: | 405.56 |
Molecular Formula: | C21 H31 N3 O3 S |
Smiles: | CCCC/N=C1\N(CCCC)C(CC(C(Nc2cccc(c2)OCC)=O)S1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8398 |
logD: | 4.8346 |
logSw: | -4.4029 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.144 |
InChI Key: | LMDWLXQXNHCMMB-SFHVURJKSA-N |