3-[2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido]phenyl 4-tert-butylbenzoate
Chemical Structure Depiction of
3-[2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido]phenyl 4-tert-butylbenzoate
3-[2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido]phenyl 4-tert-butylbenzoate
Compound characteristics
| Compound ID: | 4418-0011 |
| Compound Name: | 3-[2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido]phenyl 4-tert-butylbenzoate |
| Molecular Weight: | 469.54 |
| Molecular Formula: | C28 H27 N3 O4 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(=O)Oc1cccc(c1)NC(CC1c2ccccc2C(N(C)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9334 |
| logD: | 4.9334 |
| logSw: | -4.6069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.577 |
| InChI Key: | LCTDBXZWODIEFY-UHFFFAOYSA-N |