3-(3-methylbutyl)-2-{[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(3-methylbutyl)-2-{[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide
3-(3-methylbutyl)-2-{[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-1292 |
| Compound Name: | 3-(3-methylbutyl)-2-{[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 504.65 |
| Molecular Formula: | C28 H32 N4 O3 S |
| Smiles: | CCCNC(c1ccc2C(N(CCC(C)C)C(=Nc2c1)SCC(c1c2ccccc2[nH]c1C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8442 |
| logD: | 4.8442 |
| logSw: | -4.6587 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.72 |
| InChI Key: | IJVZHNYEPDFGQD-UHFFFAOYSA-N |