N-{2-[(adamantan-1-yl)oxy]ethyl}-5-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-{2-[(adamantan-1-yl)oxy]ethyl}-5-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)thiophene-2-carboxamide
N-{2-[(adamantan-1-yl)oxy]ethyl}-5-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | C798-1026 |
| Compound Name: | N-{2-[(adamantan-1-yl)oxy]ethyl}-5-(6-chloro-2,3-dihydro-4H-1,4-benzoxazin-4-yl)thiophene-2-carboxamide |
| Molecular Weight: | 473.03 |
| Molecular Formula: | C25 H29 Cl N2 O3 S |
| Smiles: | C1C2CC3CC1CC(C2)(C3)OCCNC(c1ccc(N2CCOc3ccc(cc23)[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4255 |
| logD: | 6.4255 |
| logSw: | -6.4778 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.192 |
| InChI Key: | AIAMDRCFQJIUGB-UHFFFAOYSA-N |