methyl 2-{[1,3-bis(benzylamino)-1,3-dioxopropan-2-yl]sulfanyl}-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-{[1,3-bis(benzylamino)-1,3-dioxopropan-2-yl]sulfanyl}-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-{[1,3-bis(benzylamino)-1,3-dioxopropan-2-yl]sulfanyl}-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-1068 |
| Compound Name: | methyl 2-{[1,3-bis(benzylamino)-1,3-dioxopropan-2-yl]sulfanyl}-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 574.66 |
| Molecular Formula: | C30 H30 N4 O6 S |
| Smiles: | COCCN1C(=Nc2cc(ccc2C1=O)C(=O)OC)SC(C(NCc1ccccc1)=O)C(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7564 |
| logD: | 2.7564 |
| logSw: | -3.4532 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.635 |
| InChI Key: | ZGYNNBCLJHMLQE-UHFFFAOYSA-N |