GSK163090 100mg

CAT: 0628-A15838-100Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0628-A15838-100Size:100 mg

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

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CAS Number

844903-58-8

Chemical Information

Gsk163090

CAS Number	844903-58-8
PubChem CID	11292933
IUPAC Name	1-[3-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]phenyl]imidazolidin-2-one
Molecular Formula	C25H29N5O
Molecular Weight	415.5
XLogP	3.4
Topological Polar Surface Area	51.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	31
Formal Charge	0
Complexity	607

SMILES

CC1=NC2=C(C=C1)C(=CC=C2)N3CCN(CC3)CCC4=CC(=CC=C4)N5CCNC5=O

InChI

InChI=1S/C25H29N5O/c1-19-8-9-22-23(27-19)6-3-7-24(22)29-16-14-28(15-17-29)12-10-20-4-2-5-21(18-20)30-13-11-26-25(30)31/h2-9,18H,10-17H2,1H3,(H,26,31)

InChIKey

ANGUXJDGJCHGOG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 844903-58-8

CID: 11292933

Formula: C25H29N5O

MW: 415.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	415.5
XLogP3	3.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	415.23721057
Monoisotopic Mass	415.23721057
Topological Polar Surface Area	51.7 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	607
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes