2-{[7-chloro-2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diethylacetamide
Chemical Structure Depiction of
2-{[7-chloro-2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diethylacetamide
2-{[7-chloro-2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diethylacetamide
Compound characteristics
| Compound ID: | C683-0333 |
| Compound Name: | 2-{[7-chloro-2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diethylacetamide |
| Molecular Weight: | 469.99 |
| Molecular Formula: | C24 H24 Cl N3 O3 S |
| Smiles: | CCN(CC)C(CSc1c2Cc3cc(ccc3Oc2nc(c2ccc(cc2)OC)n1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.3355 |
| logD: | 6.3281 |
| logSw: | -6.261 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.351 |
| InChI Key: | VQEGCSYONUEVKI-UHFFFAOYSA-N |