3-methyl-2-[(1-phenylethyl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-methyl-2-[(1-phenylethyl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-methyl-2-[(1-phenylethyl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | G856-0785 |
| Compound Name: | 3-methyl-2-[(1-phenylethyl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 335.43 |
| Molecular Formula: | C19 H17 N3 O S |
| Smiles: | CC(c1ccccc1)SC1=Nc2c3ccccc3[nH]c2C(N1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.012 |
| logD: | 4.012 |
| logSw: | -4.2446 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.766 |
| InChI Key: | PMOUOFAYCYMFBP-LBPRGKRZSA-N |