6-amino-2-{[2-(4-methylphenoxy)ethyl]sulfanyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-amino-2-{[2-(4-methylphenoxy)ethyl]sulfanyl}pyrimidin-4(3H)-one
6-amino-2-{[2-(4-methylphenoxy)ethyl]sulfanyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8011-7604 |
| Compound Name: | 6-amino-2-{[2-(4-methylphenoxy)ethyl]sulfanyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 277.34 |
| Molecular Formula: | C13 H15 N3 O2 S |
| Smiles: | Cc1ccc(cc1)OCCSC1NC(C=C(N)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6052 |
| logD: | 1.6035 |
| logSw: | -2.4066 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.099 |
| InChI Key: | QNTGYECJSOYBKA-UHFFFAOYSA-N |