3-{[(3-chlorophenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-{[(3-chlorophenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-{[(3-chlorophenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4215-0128 |
| Compound Name: | 3-{[(3-chlorophenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 343.83 |
| Molecular Formula: | C17 H14 Cl N3 O S |
| Smiles: | C1CCc2c(C1)c1C(N(C=Nc1s2)/N=C/c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9581 |
| logD: | 3.9549 |
| logSw: | -4.678 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.037 |
| InChI Key: | BXHBVVVWWDAZCW-UHFFFAOYSA-N |