3-(3-ethoxypropyl)-4-oxo-N-[(pyridin-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(3-ethoxypropyl)-4-oxo-N-[(pyridin-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-(3-ethoxypropyl)-4-oxo-N-[(pyridin-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K284-3214 |
| Compound Name: | 3-(3-ethoxypropyl)-4-oxo-N-[(pyridin-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C20 H22 N4 O3 S |
| Smiles: | CCOCCCN1C(c2ccc(cc2NC1=S)C(NCc1ccccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.062 |
| logD: | 2.0593 |
| logSw: | -3.0371 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.502 |
| InChI Key: | LVLLDDXZOIURLP-UHFFFAOYSA-N |