Name: Name:2-[(9H-fluoren-9-ylmethoxy)carbonyl]-1H,2H,3H,4H,5H-pyrido[4,3-b]indole-6-carboxylic acid
Brand: Angene
SKU: AG01EKCJ
Rating: 90 (10 reviews)

2-[(9H-fluoren-9-ylmethoxy)carbonyl]-1H,2H,3H,4H,5H-pyrido[4,3-b]indole-6-carboxylic acid

CAS No.:

2127012-69-3

Catalog Number:

AG01EKCJ

Molecular Formula:

C27H22N2O4

Molecular Weight:

438.4746

Catalog Number:

AG01EKCJ

Chemical Name:

2-[(9H-fluoren-9-ylmethoxy)carbonyl]-1H,2H,3H,4H,5H-pyrido[4,3-b]indole-6-carboxylic acid

CAS Number:

2127012-69-3

Molecular Formula:

C27H22N2O4

Molecular Weight:

438.4746

MDL Number:

MFCD31559742

IUPAC Name:

2-(9H-fluoren-9-ylmethoxycarbonyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-6-carboxylic acid

InChI:

InChI=1S/C27H22N2O4/c30-26(31)21-11-5-10-20-22-14-29(13-12-24(22)28-25(20)21)27(32)33-15-23-18-8-3-1-6-16(18)17-7-2-4-9-19(17)23/h1-11,23,28H,12-15H2,(H,30,31)

InChI Key:

DUABXJIUCGJNCC-UHFFFAOYSA-N

SMILES:

O=C(N1CCc2c(C1)c1cccc(c1[nH]2)C(=O)O)OCC1c2ccccc2c2c1cccc2

Complexity:

736

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

438.158g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

438.483g/mol

Monoisotopic Mass:

438.158g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.5