Name: Name:(R)-Benzyl 2-(5-bromo-1H-indole-3-carbonyl)pyrrolidine-1-carboxylate
Brand: Angene
SKU: AG007K8G
Rating: 90 (10 reviews)

(R)-Benzyl 2-(5-bromo-1H-indole-3-carbonyl)pyrrolidine-1-carboxylate

CAS No.:

143322-56-9

Catalog Number:

AG007K8G

Molecular Formula:

C21H19BrN2O3

Molecular Weight:

427.2912

Catalog Number:

AG007K8G

Chemical Name:

(R)-Benzyl 2-(5-bromo-1H-indole-3-carbonyl)pyrrolidine-1-carboxylate

CAS Number:

143322-56-9

Molecular Formula:

C21H19BrN2O3

Molecular Weight:

427.2912

MDL Number:

MFCD09835149

IUPAC Name:

benzyl (2R)-2-(5-bromo-1H-indole-3-carbonyl)pyrrolidine-1-carboxylate

InChI:

InChI=1S/C21H19BrN2O3/c22-15-8-9-18-16(11-15)17(12-23-18)20(25)19-7-4-10-24(19)21(26)27-13-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12,19,23H,4,7,10,13H2/t19-/m1/s1

InChI Key:

CWHKVBJSRGJFFN-LJQANCHMSA-N

SMILES:

Brc1ccc2c(c1)c(c[nH]2)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1

Complexity:

552

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

426.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

427.298g/mol

Monoisotopic Mass:

426.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.4