methyl 3-(3-amino-1H-1,2,4-triazol-5-yl)prop-2-enoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
methyl 3-(3-amino-1H-1,2,4-triazol-5-yl)prop-2-enoate--hydrogen chloride (1/1)
methyl 3-(3-amino-1H-1,2,4-triazol-5-yl)prop-2-enoate--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | 8020-6601 |
Compound Name: | methyl 3-(3-amino-1H-1,2,4-triazol-5-yl)prop-2-enoate--hydrogen chloride (1/1) |
Molecular Weight: | 204.61 |
Molecular Formula: | C6 H8 N4 O2 |
Salt: | HCl |
Smiles: | COC(/C=C\c1nc(N)n[nH]1)=O |
Stereo: | ACHIRAL |
logP: | -0.1145 |
logD: | -0.1243 |
logSw: | -0.6701 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 76.33 |
InChI Key: | FOOWMEUCNCAWSD-IHWYPQMZSA-N |