Name: Name:1-benzyl-4-(1-methyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxylic acid dihydrochloride
Brand: Angene
SKU: AG01BUYS
Rating: 90 (10 reviews)

1-benzyl-4-(1-methyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxylic acid dihydrochloride

CAS No.:

2031269-28-8

Catalog Number:

AG01BUYS

Molecular Formula:

C16H21Cl2N3O2

Molecular Weight:

358.2628

Catalog Number:

AG01BUYS

Chemical Name:

1-benzyl-4-(1-methyl-1H-pyrazol-3-yl)pyrrolidine-3-carboxylic acid dihydrochloride

CAS Number:

2031269-28-8

Molecular Formula:

C16H21Cl2N3O2

Molecular Weight:

358.2628

MDL Number:

MFCD30345324

IUPAC Name:

1-benzyl-4-(1-methylpyrazol-3-yl)pyrrolidine-3-carboxylic acid;dihydrochloride

InChI:

InChI=1S/C16H19N3O2.2ClH/c1-18-8-7-15(17-18)13-10-19(11-14(13)16(20)21)9-12-5-3-2-4-6-12;;/h2-8,13-14H,9-11H2,1H3,(H,20,21);2*1H

InChI Key:

SKTLTUYOUDHQMQ-UHFFFAOYSA-N

SMILES:

Cn1ccc(n1)C1CN(CC1C(=O)O)Cc1ccccc1.Cl.Cl

Complexity:

371

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

357.101g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

358.263g/mol

Monoisotopic Mass:

357.101g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: