methyl 3-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 3-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | F207-0168 |
| Compound Name: | methyl 3-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C21 H21 N3 O5 S |
| Smiles: | COC(c1ccc2C(N(CCC(NCc3ccccc3OC)=O)C(Nc2c1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9134 |
| logD: | 2.9083 |
| logSw: | -3.5503 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.572 |
| InChI Key: | ZEJGXZIDBMNPNE-UHFFFAOYSA-N |