3-[(4-methoxyphenyl)methyl]-4-oxo-N-(4-phenoxyphenyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-4-oxo-N-(4-phenoxyphenyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-[(4-methoxyphenyl)methyl]-4-oxo-N-(4-phenoxyphenyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0062031 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-4-oxo-N-(4-phenoxyphenyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 509.58 |
| Molecular Formula: | C29 H23 N3 O4 S |
| Smiles: | COc1ccc(CN2C(c3ccc(cc3NC2=S)C(Nc2ccc(cc2)Oc2ccccc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.0825 |
| logD: | 6.0788 |
| logSw: | -5.4888 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.701 |
| InChI Key: | QPFVXJMIYXBGQY-UHFFFAOYSA-N |