PF-03463275

CAT: 0127-BUP00399-02Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP00399-02Size:5 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1173239-39-8

Synonyms

PF-3463275

Purity

=98%

Smiles

[H][C@@]12CN(C)C[C@]1([H])[C@H]2CN(Cc1ccc(F)c(Cl)c1)C(=O)c1cn(C)cn1

Chemical Information

Pf-3463275

PF-03463275 has been used in trials studying the treatment of Schizophrenia and Cognitive Impairments Associated With Schizophrenia.

CAS Number	1173239-39-8
PubChem CID	44156901
IUPAC Name	N-[(3-chloro-4-fluorophenyl)methyl]-1-methyl-N-[[(1R,5S)-3-methyl-3-azabicyclo[3.1.0]hexan-6-yl]methyl]imidazole-4-carboxamide
Molecular Formula	C19H22ClFN4O
Molecular Weight	376.9
XLogP	2.4
Topological Polar Surface Area	41.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	26
Formal Charge	0
Complexity	526

SMILES

CN1C[C@@H]2[C@H](C1)C2CN(CC3=CC(=C(C=C3)F)Cl)C(=O)C4=CN(C=N4)C

InChI

InChI=1S/C19H22ClFN4O/c1-23-7-13-14(8-23)15(13)9-25(19(26)18-10-24(2)11-22-18)6-12-3-4-17(21)16(20)5-12/h3-5,10-11,13-15H,6-9H2,1-2H3/t13-,14+,15?

InChIKey

KYLOBHXXQOZRKK-YIONKMFJSA-N

Chemical Structure

2D Structure

CAS: 1173239-39-8

CID: 44156901

Formula: C19H22ClFN4O

MW: 376.9

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	376.9
XLogP3	2.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	376.1466172
Monoisotopic Mass	376.1466172
Topological Polar Surface Area	41.4 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	526
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes