N-(4-acetylphenyl)-2-{[3-(2-methoxyethyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-2-{[3-(2-methoxyethyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
N-(4-acetylphenyl)-2-{[3-(2-methoxyethyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G864-0142 |
| Compound Name: | N-(4-acetylphenyl)-2-{[3-(2-methoxyethyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 450.52 |
| Molecular Formula: | C23 H22 N4 O4 S |
| Smiles: | CC(c1ccc(cc1)NC(CSC1=Nc2c3ccccc3[nH]c2C(N1CCOC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3495 |
| logD: | 2.3494 |
| logSw: | -2.717 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.298 |
| InChI Key: | BWPSVRGVIKDRCR-UHFFFAOYSA-N |