1-(6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)pyrazol-4-amine hydrochloride - CAS 1431967-69-9
Catalog: |
BB042956 |
Product Name: |
1-(6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)pyrazol-4-amine hydrochloride |
CAS: |
1431967-69-9 |
Synonyms: |
AKOS024395322; MCULE-9095040788; 1-(6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)pyrazol-4-amine HCl |
IUPAC Name: | 1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)pyrazol-4-amine;hydrochloride |
Description: | 1-(6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)pyrazol-4-amine hydrochloride (CAS# 1431967-69-9 ) is a useful research chemical. |
Molecular Weight: | 268.74 |
Molecular Formula: | C11H17ClN6 |
Canonical SMILES: | C1CCC2=NN=C(N2CC1)CN3C=C(C=N3)N.Cl |
InChI: | InChI=1S/C11H16N6.ClH/c12-9-6-13-16(7-9)8-11-15-14-10-4-2-1-3-5-17(10)11;/h6-7H,1-5,8,12H2;1H |
InChI Key: | RFDRTDCTPYEXGN-UHFFFAOYSA-N |
Complexity: | 260 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 268.1203223 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 268.1203223 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 74.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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