(3-bromo-4-propoxyphenyl)methyl carbamimidothioate--hydrogen chloride (1/1)
Chemical Structure Depiction of
(3-bromo-4-propoxyphenyl)methyl carbamimidothioate--hydrogen chloride (1/1)
(3-bromo-4-propoxyphenyl)methyl carbamimidothioate--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | 4298-0376 |
Compound Name: | (3-bromo-4-propoxyphenyl)methyl carbamimidothioate--hydrogen chloride (1/1) |
Molecular Weight: | 339.68 |
Molecular Formula: | C11 H15 Br N2 O S |
Salt: | HCl |
Smiles: | CCCOc1ccc(CSC(N)=N)cc1[Br] |
Stereo: | ACHIRAL |
logP: | 2.9126 |
logD: | 0.5079 |
logSw: | -3.2031 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 47.514 |
InChI Key: | MRQDMKPWDNDPKW-UHFFFAOYSA-N |