4-amino-N-{2-[(3-chloro-2-methylphenyl)carbamamido]ethyl}-1,2,5-oxadiazole-3-carboxamide
Chemical Structure Depiction of
4-amino-N-{2-[(3-chloro-2-methylphenyl)carbamamido]ethyl}-1,2,5-oxadiazole-3-carboxamide
4-amino-N-{2-[(3-chloro-2-methylphenyl)carbamamido]ethyl}-1,2,5-oxadiazole-3-carboxamide
Compound characteristics
| Compound ID: | D440-0181 |
| Compound Name: | 4-amino-N-{2-[(3-chloro-2-methylphenyl)carbamamido]ethyl}-1,2,5-oxadiazole-3-carboxamide |
| Molecular Weight: | 338.75 |
| Molecular Formula: | C13 H15 Cl N6 O3 |
| Smiles: | Cc1c(cccc1[Cl])NC(NCCNC(c1c(N)non1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3272 |
| logD: | 1.3272 |
| logSw: | -2.388 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 114.619 |
| InChI Key: | HPSZXBITLNQZHZ-UHFFFAOYSA-N |