3-(2-methoxyethyl)-2-[(3-phenylprop-2-en-1-yl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-(2-methoxyethyl)-2-[(3-phenylprop-2-en-1-yl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-(2-methoxyethyl)-2-[(3-phenylprop-2-en-1-yl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | G864-0100 |
| Compound Name: | 3-(2-methoxyethyl)-2-[(3-phenylprop-2-en-1-yl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C22 H21 N3 O2 S |
| Smiles: | COCCN1C(=Nc2c3ccccc3[nH]c2C1=O)SC/C=C/c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1888 |
| logD: | 4.1888 |
| logSw: | -4.2288 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.322 |
| InChI Key: | JOSFFHPQVVMIPX-UHFFFAOYSA-N |