3-(2-{3-chloro-4-[(1-chloronaphthalen-2-yl)oxy]anilino}-1,3-thiazol-4-yl)-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(2-{3-chloro-4-[(1-chloronaphthalen-2-yl)oxy]anilino}-1,3-thiazol-4-yl)-8-methoxy-2H-1-benzopyran-2-one
3-(2-{3-chloro-4-[(1-chloronaphthalen-2-yl)oxy]anilino}-1,3-thiazol-4-yl)-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K232-0234 |
| Compound Name: | 3-(2-{3-chloro-4-[(1-chloronaphthalen-2-yl)oxy]anilino}-1,3-thiazol-4-yl)-8-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 561.44 |
| Molecular Formula: | C29 H18 Cl2 N2 O4 S |
| Smiles: | COc1cccc2C=C(C(=O)Oc12)c1csc(Nc2ccc(c(c2)[Cl])Oc2ccc3ccccc3c2[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 8.5005 |
| logD: | 8.5005 |
| logSw: | -7.0989 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.812 |
| InChI Key: | ILPRDOIBZWKJLS-UHFFFAOYSA-N |