200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 1239034-70-8
1239034-70-8 | Benzoic acid, 4-[(1,2,3,4-tetrahydro-2-methyl-5H-pyrido[4,3-b]indol-5-yl)methyl]-, methyl ester
CAS No: 1239034-70-8 Catalog No: AG000L7L MDL No:
Product Description
Catalog Number:
AG000L7L
Chemical Name:
Benzoic acid, 4-[(1,2,3,4-tetrahydro-2-methyl-5H-pyrido[4,3-b]indol-5-yl)methyl]-, methyl ester
CAS Number:
1239034-70-8
Molecular Formula:
C21H22N2O2
Molecular Weight:
334.4116
IUPAC Name:
methyl 4-[(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)methyl]benzoate
InChI:
InChI=1S/C21H22N2O2/c1-22-12-11-20-18(14-22)17-5-3-4-6-19(17)23(20)13-15-7-9-16(10-8-15)21(24)25-2/h3-10H,11-14H2,1-2H3
InChI Key:
RMAYYLGDIMEEOS-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)Cn1c2ccccc2c2c1CCN(C2)C
Properties
Complexity:
475
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.168g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.419g/mol
Monoisotopic Mass:
334.168g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.