Name: Name:1,7,7-trimethyl-1H,4H,5H,6H,7H,8H-pyrazolo[4,3-c]azepine
Brand: Angene
SKU: AG01BUS6
Rating: 90 (10 reviews)

1,7,7-trimethyl-1H,4H,5H,6H,7H,8H-pyrazolo[4,3-c]azepine

CAS No.:

2059993-44-9

Catalog Number:

AG01BUS6

Molecular Formula:

C10H17N3

Molecular Weight:

179.2621

Catalog Number:

AG01BUS6

Chemical Name:

1,7,7-trimethyl-1H,4H,5H,6H,7H,8H-pyrazolo[4,3-c]azepine

CAS Number:

2059993-44-9

Molecular Formula:

C10H17N3

Molecular Weight:

179.2621

MDL Number:

MFCD30497558

IUPAC Name:

1,7,7-trimethyl-4,5,6,8-tetrahydropyrazolo[4,3-c]azepine

InChI:

InChI=1S/C10H17N3/c1-10(2)4-9-8(5-11-7-10)6-12-13(9)3/h6,11H,4-5,7H2,1-3H3

InChI Key:

GJSDCRGCOQJFRV-UHFFFAOYSA-N

SMILES:

Cn1ncc2c1CC(C)(C)CNC2

Complexity:

191

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

179.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

179.267g/mol

Monoisotopic Mass:

179.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9