Name: Name:[1,1'-Bi-1H-indole]-6,6'-dicarboxylic acid, 5,5'-dibromo-2,2',3,3'-tetrahydro-, 6,6'-dimethyl ester
Brand: Angene
SKU: AG002CYZ
Rating: 90 (10 reviews)

[1,1'-Bi-1H-indole]-6,6'-dicarboxylic acid, 5,5'-dibromo-2,2',3,3'-tetrahydro-, 6,6'-dimethyl ester

CAS No.:

2007910-50-9

Catalog Number:

AG002CYZ

Molecular Formula:

C20H18Br2N2O4

Molecular Weight:

510.1759

Catalog Number:

AG002CYZ

Chemical Name:

[1,1'-Bi-1H-indole]-6,6'-dicarboxylic acid, 5,5'-dibromo-2,2',3,3'-tetrahydro-, 6,6'-dimethyl ester

CAS Number:

2007910-50-9

Molecular Formula:

C20H18Br2N2O4

Molecular Weight:

510.1759

MDL Number:

MFCD30471640

IUPAC Name:

methyl 5-bromo-1-(5-bromo-6-methoxycarbonyl-2,3-dihydroindol-1-yl)-2,3-dihydroindole-6-carboxylate

InChI:

InChI=1S/C20H18Br2N2O4/c1-27-19(25)13-9-17-11(7-15(13)21)3-5-23(17)24-6-4-12-8-16(22)14(10-18(12)24)20(26)28-2/h7-10H,3-6H2,1-2H3

InChI Key:

VGFLYXQTGWNEAU-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc2c(cc1Br)CCN2N1CCc2c1cc(C(=O)OC)c(c2)Br

Complexity:

569

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

509.961g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

510.182g/mol

Monoisotopic Mass:

507.963g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.2