6-chloro-4-({3-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-4-({3-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
6-chloro-4-({3-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L472-1367 |
| Compound Name: | 6-chloro-4-({3-[4-(2-cyclopropyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 464.93 |
| Molecular Formula: | C23 H17 Cl N4 O3 S |
| Smiles: | C1CC1c1nc(cs1)c1ccc(cc1)c1nc(CN2C(COc3ccc(cc23)[Cl])=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.4489 |
| logD: | 5.4489 |
| logSw: | -6.0264 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.397 |
| InChI Key: | DCEMOWJYOCEDPY-UHFFFAOYSA-N |