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2-Amino-4-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidine

2-Amino-4-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidine - CAS 5461-89-2

Catalog:	BB028738
Product Name:	2-Amino-4-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CAS:	5461-89-2
Synonyms:	4-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine; 4-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine

Technical Data

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Computed Properties

IUPAC Name:	4-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-amine
Description:	2-Amino-4-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidine (CAS# 5461-89-2) is a useful research chemical.
Molecular Weight:	169.61
Molecular Formula:	C7H8ClN3
Canonical SMILES:	C1CC2=C(C1)N=C(N=C2Cl)N
InChI:	InChI=1S/C7H8ClN3/c8-6-4-2-1-3-5(4)10-7(9)11-6/h1-3H2,(H2,9,10,11)
InChI Key:	JIDGUKIAUDLAQP-UHFFFAOYSA-N
Boiling Point:	391.1 °C at 760 mmHg
Density:	1.422 g/cm³
LogP:	1.78210

Publication Number	Title	Priority Date
EP-2209775-A1	Heterobicyclic compounds as histamine h4-receptor antagonists	20071009
US-2010298289-A1	Heterobicyclic compounds as histamine h4-receptor antagonists	20071009
WO-2009047255-A1	Heterobicyclic compounds as histamine h4-receptor antagonists	20071009
JP-2008247878-A	Imidazopyridine and imidazopyrimidine compounds and anesthetic or sedative composition containing the same	20070330
US-2010093696-A1	2-amino pyrimidine compounds	20070206

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Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	169.040675
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	169.040675
Rotatable Bond Count:	0
Topological Polar Surface Area:	51.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5