Name: Name:6-butyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-thiol
Brand: Angene
SKU: AG019VWZ
Rating: 90 (10 reviews)

6-butyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-thiol

CAS No.:

1193388-61-2

Catalog Number:

AG019VWZ

Molecular Formula:

C11H16N4S

Molecular Weight:

236.3365

Catalog Number:

AG019VWZ

Chemical Name:

6-butyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-thiol

CAS Number:

1193388-61-2

Molecular Formula:

C11H16N4S

Molecular Weight:

236.3365

MDL Number:

MFCD12197270

IUPAC Name:

6-butyl-5,7-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione

InChI:

InChI=1S/C11H16N4S/c1-4-5-6-9-7(2)12-10-13-11(16)14-15(10)8(9)3/h4-6H2,1-3H3,(H,14,16)

InChI Key:

RWWSALCPFWNLQI-UHFFFAOYSA-N

SMILES:

CCCCc1c(C)nc2n(c1C)nc(n2)S

Complexity:

420

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.11g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.337g/mol

Monoisotopic Mass:

236.11g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3