{3-[(2-chlorophenyl)methyl]-1,3-diazinan-1-yl}(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)methanone
Chemical Structure Depiction of
{3-[(2-chlorophenyl)methyl]-1,3-diazinan-1-yl}(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)methanone
{3-[(2-chlorophenyl)methyl]-1,3-diazinan-1-yl}(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)methanone
Compound characteristics
| Compound ID: | E475-0613 |
| Compound Name: | {3-[(2-chlorophenyl)methyl]-1,3-diazinan-1-yl}(8-methyl-4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)methanone |
| Molecular Weight: | 423.9 |
| Molecular Formula: | C23 H22 Cl N3 O3 |
| Smiles: | Cc1ccc2c(c1)c1c(CO2)c(C(N2CCCN(Cc3ccccc3[Cl])C2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.4303 |
| logD: | 4.3895 |
| logSw: | -4.5254 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.697 |
| InChI Key: | CPMNRLFRLLFPQJ-UHFFFAOYSA-N |