2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-6-phenyl-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-6-phenyl-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-6-phenyl-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 5055-7280 |
| Compound Name: | 2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-6-phenyl-3-(prop-2-en-1-yl)thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C21 H19 N3 O2 S2 |
| Smiles: | Cc1c(CSC2=Nc3c(cc(c4ccccc4)s3)C(N2CC=C)=O)c(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.9018 |
| logD: | 4.9018 |
| logSw: | -4.6701 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.69 |
| InChI Key: | RMVRPWYXPKDEHW-UHFFFAOYSA-N |