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1439894-51-5 | (R)-1-(Pyridin-4-ylmethyl)-3-(pyrrolidin-3-yl)urea hydrochloride
CAS No: 1439894-51-5 Catalog No: AG01ETTU MDL No:
Product Description
Catalog Number:
AG01ETTU
Chemical Name:
(R)-1-(Pyridin-4-ylmethyl)-3-(pyrrolidin-3-yl)urea hydrochloride
CAS Number:
1439894-51-5
Molecular Formula:
C11H17ClN4O
Molecular Weight:
256.7319
IUPAC Name:
1-(pyridin-4-ylmethyl)-3-[(3R)-pyrrolidin-3-yl]urea;hydrochloride
InChI:
InChI=1S/C11H16N4O.ClH/c16-11(15-10-3-6-13-8-10)14-7-9-1-4-12-5-2-9;/h1-2,4-5,10,13H,3,6-8H2,(H2,14,15,16);1H/t10-;/m1./s1
InChI Key:
GHWMVDCRIUYDRG-HNCPQSOCSA-N
SMILES:
O=C(N[C@H]1CNCC1)NCc1ccncc1.Cl
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
256.109g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
256.734g/mol
Monoisotopic Mass:
256.109g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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