2-amino-7,7-dimethyl-3-(4-methylbenzoyl)-4-phenyl-4,6,7,8-tetrahydro-5H-1-benzopyran-5-one
Chemical Structure Depiction of
2-amino-7,7-dimethyl-3-(4-methylbenzoyl)-4-phenyl-4,6,7,8-tetrahydro-5H-1-benzopyran-5-one
2-amino-7,7-dimethyl-3-(4-methylbenzoyl)-4-phenyl-4,6,7,8-tetrahydro-5H-1-benzopyran-5-one
Compound characteristics
| Compound ID: | 3717-0025 |
| Compound Name: | 2-amino-7,7-dimethyl-3-(4-methylbenzoyl)-4-phenyl-4,6,7,8-tetrahydro-5H-1-benzopyran-5-one |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C25 H25 N O3 |
| Smiles: | Cc1ccc(cc1)C(C1C(C2=C(CC(C)(C)CC2=O)OC=1N)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.389 |
| logD: | 4.389 |
| logSw: | -4.7347 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.013 |
| InChI Key: | RGVDHOXOTVUVLO-HXUWFJFHSA-N |