6-chloro-9-(2,4-dimethylphenyl)-4-propyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
6-chloro-9-(2,4-dimethylphenyl)-4-propyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
6-chloro-9-(2,4-dimethylphenyl)-4-propyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
Compound ID: | Y040-7534 |
Compound Name: | 6-chloro-9-(2,4-dimethylphenyl)-4-propyl-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
Molecular Weight: | 383.87 |
Molecular Formula: | C22 H22 Cl N O3 |
Smiles: | CCCC1=CC(=O)Oc2c1cc(c1c2CN(CO1)c1ccc(C)cc1C)[Cl] |
Stereo: | ACHIRAL |
logP: | 6.6299 |
logD: | 6.6299 |
logSw: | -6.2269 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 32.018 |
InChI Key: | VMBWGTIKVHDRLM-UHFFFAOYSA-N |