N,N-diethyl-2-{[2-(4-methoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N,N-diethyl-2-{[2-(4-methoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
N,N-diethyl-2-{[2-(4-methoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C683-0300 |
| Compound Name: | N,N-diethyl-2-{[2-(4-methoxyphenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | CCN(CC)C(CSc1c2Cc3cc(C)ccc3Oc2nc(c2ccc(cc2)OC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0818 |
| logD: | 6.0788 |
| logSw: | -5.5042 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.351 |
| InChI Key: | PAGZFRKZHWXAES-UHFFFAOYSA-N |