6-chloro-4-ethyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
6-chloro-4-ethyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
6-chloro-4-ethyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D144-0099 |
| Compound Name: | 6-chloro-4-ethyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 369.85 |
| Molecular Formula: | C21 H20 Cl N O3 |
| Smiles: | CCC1=CC(=O)Oc2c1cc(c1c2CN(Cc2ccc(C)cc2)CO1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2083 |
| logD: | 4.9712 |
| logSw: | -5.6007 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.599 |
| InChI Key: | MRVRXNKOMZGMDD-UHFFFAOYSA-N |