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1078163-00-4 | N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide hydrochloride
CAS No: 1078163-00-4 Catalog No: AG019LJP MDL No:MFCD09971500
Product Description
Catalog Number:
AG019LJP
Chemical Name:
N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide hydrochloride
CAS Number:
1078163-00-4
Molecular Formula:
C8H12ClN3OS
Molecular Weight:
233.7184
MDL Number:
MFCD09971500
IUPAC Name:
N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide;hydrochloride
InChI:
InChI=1S/C8H11N3OS.ClH/c12-7(6-2-1-3-9-6)11-8-10-4-5-13-8;/h4-6,9H,1-3H2,(H,10,11,12);1H
InChI Key:
LACUEEOLQDNDDC-UHFFFAOYSA-N
SMILES:
O=C(C1CCCN1)Nc1nccs1.Cl
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.039g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
233.714g/mol
Monoisotopic Mass:
233.039g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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