4-amino-N-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamamido]ethyl}-1,2,5-oxadiazole-3-carboxamide
Chemical Structure Depiction of
4-amino-N-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamamido]ethyl}-1,2,5-oxadiazole-3-carboxamide
4-amino-N-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamamido]ethyl}-1,2,5-oxadiazole-3-carboxamide
Compound characteristics
| Compound ID: | D440-0193 |
| Compound Name: | 4-amino-N-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamamido]ethyl}-1,2,5-oxadiazole-3-carboxamide |
| Molecular Weight: | 348.32 |
| Molecular Formula: | C14 H16 N6 O5 |
| Smiles: | C(CNC(Nc1ccc2c(c1)OCCO2)=O)NC(c1c(N)non1)=O |
| Stereo: | ACHIRAL |
| logP: | -0.5085 |
| logD: | -0.5085 |
| logSw: | -1.9034 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 131.139 |
| InChI Key: | SHBLBSQHIMDQTD-UHFFFAOYSA-N |