3-[(4-methylcyclohexyl)amino]-4-phenylcyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[(4-methylcyclohexyl)amino]-4-phenylcyclobut-3-ene-1,2-dione
3-[(4-methylcyclohexyl)amino]-4-phenylcyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0413 |
| Compound Name: | 3-[(4-methylcyclohexyl)amino]-4-phenylcyclobut-3-ene-1,2-dione |
| Molecular Weight: | 269.34 |
| Molecular Formula: | C17 H19 N O2 |
| Smiles: | CC1CCC(CC1)NC1=C(C(C1=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.031 |
| logD: | 4.031 |
| logSw: | -4.0505 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.942 |
| InChI Key: | CSQJAYZRLYZSFZ-UHFFFAOYSA-N |