N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
Compound ID: | K284-3304 |
Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
Molecular Weight: | 471.57 |
Molecular Formula: | C24 H29 N3 O5 S |
Smiles: | CCOCCCN1C(c2ccc(cc2NC1=S)C(NCCc1ccc(c(c1)OC)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.4224 |
logD: | 2.4198 |
logSw: | -3.0674 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.061 |
InChI Key: | DCXKMVCPLAOBGJ-UHFFFAOYSA-N |