3-(4-chloro-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-7-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(4-chloro-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-7-methoxy-2H-1-benzopyran-2-one
3-(4-chloro-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-7-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C200-3884 |
| Compound Name: | 3-(4-chloro-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-7-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 398.87 |
| Molecular Formula: | C20 H15 Cl N2 O3 S |
| Smiles: | COc1ccc2C=C(C(=O)Oc2c1)c1nc(c2c3CCCCc3sc2n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1882 |
| logD: | 5.1882 |
| logSw: | -5.6412 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.666 |
| InChI Key: | UPZWVVMKNPFTNL-UHFFFAOYSA-N |