2-[4-(azepane-1-sulfonyl)phenyl]-5-[(2-methoxyethyl)amino]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-[4-(azepane-1-sulfonyl)phenyl]-5-[(2-methoxyethyl)amino]-1,3-oxazole-4-carbonitrile
2-[4-(azepane-1-sulfonyl)phenyl]-5-[(2-methoxyethyl)amino]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D434-0796 |
| Compound Name: | 2-[4-(azepane-1-sulfonyl)phenyl]-5-[(2-methoxyethyl)amino]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C19 H24 N4 O4 S |
| Smiles: | COCCNc1c(C#N)nc(c2ccc(cc2)S(N2CCCCCC2)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.669 |
| logD: | 2.669 |
| logSw: | -3.0799 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.775 |
| InChI Key: | SRLOOPLHQVZEOJ-UHFFFAOYSA-N |