methyl 3-(3-{[3-(morpholin-4-yl)propyl]amino}-3-oxopropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-(3-{[3-(morpholin-4-yl)propyl]amino}-3-oxopropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 3-(3-{[3-(morpholin-4-yl)propyl]amino}-3-oxopropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | F207-0169 |
| Compound Name: | methyl 3-(3-{[3-(morpholin-4-yl)propyl]amino}-3-oxopropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 434.51 |
| Molecular Formula: | C20 H26 N4 O5 S |
| Smiles: | COC(c1ccc2C(N(CCC(NCCCN3CCOCC3)=O)C(Nc2c1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7288 |
| logD: | 0.3053 |
| logSw: | -2.3646 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.674 |
| InChI Key: | LYYXHXVCPMHCPY-UHFFFAOYSA-N |