200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 1315449-58-1
1315449-58-1 | 4-(1H-pyrazol-1-yl)-1,2,3,4-tetrahydroisoquinoline
CAS No: 1315449-58-1 Catalog No: AG01ADSJ MDL No:MFCD19610266
Product Description
Catalog Number:
AG01ADSJ
Chemical Name:
4-(1H-pyrazol-1-yl)-1,2,3,4-tetrahydroisoquinoline
CAS Number:
1315449-58-1
Molecular Formula:
C12H13N3
Molecular Weight:
199.2517
MDL Number:
MFCD19610266
IUPAC Name:
4-pyrazol-1-yl-1,2,3,4-tetrahydroisoquinoline
InChI:
InChI=1S/C12H13N3/c1-2-5-11-10(4-1)8-13-9-12(11)15-7-3-6-14-15/h1-7,12-13H,8-9H2
InChI Key:
PBSOISQSZIYBJI-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)C(CNC2)n1cccn1
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.257g/mol
Monoisotopic Mass:
199.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.