2-{[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-N-(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-N-(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-{[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-N-(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-0570 |
| Compound Name: | 2-{[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-N-(2-methylpropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 540.64 |
| Molecular Formula: | C30 H28 N4 O4 S |
| Smiles: | CC(C)CNC(c1ccc2C(N(C(=Nc2c1)SCC(c1c[nH]c2ccccc12)=O)c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5844 |
| logD: | 4.5843 |
| logSw: | -4.2843 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.506 |
| InChI Key: | JTFQZGHFVXRCJQ-UHFFFAOYSA-N |