2-(5-chloro-2-hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(5-chloro-2-hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
2-(5-chloro-2-hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K603-0111 |
| Compound Name: | 2-(5-chloro-2-hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 289.72 |
| Molecular Formula: | C15 H12 Cl N O3 |
| Smiles: | C1C2C=CC1C1C2C(N(C1=O)c1cc(ccc1O)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0994 |
| logD: | 2.0924 |
| logSw: | -2.6736 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.972 |
| InChI Key: | HAXFZIQJWOFNFQ-UHFFFAOYSA-N |