DMH-1 500mg

CAT: 0628-A12820-500Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0628-A12820-500Size:500 mg

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CAS Number

1206711-16-1

Chemical Information

4-[6-[4-(1-Methylethoxy)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl]quinoline

DMH1 is a pyrazolopyrimidine that is pyrazolo[1,5-a]pyrimidine bearing quinolin-4-yl and 4-isopropyloxyphenyl substituents at positions 3 and 6 respectively. It has a role as an antineoplastic agent, a protein kinase inhibitor and a bone morphogenetic protein receptor antagonist. It is a member of quinolines, an aromatic ether and a pyrazolopyrimidine.

CAS Number	1206711-16-1
PubChem CID	50997747
IUPAC Name	4-[6-(4-propan-2-yloxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]quinoline
Molecular Formula	C24H20N4O
Molecular Weight	380.4
XLogP	4.6
Topological Polar Surface Area	52.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	29
Formal Charge	0
Complexity	535

SMILES

CC(C)OC1=CC=C(C=C1)C2=CN3C(=C(C=N3)C4=CC=NC5=CC=CC=C45)N=C2

InChI

InChI=1S/C24H20N4O/c1-16(2)29-19-9-7-17(8-10-19)18-13-26-24-22(14-27-28(24)15-18)20-11-12-25-23-6-4-3-5-21(20)23/h3-16H,1-2H3

InChIKey

JMIFGARJSWXZSH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1206711-16-1

CID: 50997747

Formula: C24H20N4O

MW: 380.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	380.4
XLogP3	4.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	380.16371127
Monoisotopic Mass	380.16371127
Topological Polar Surface Area	52.3 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	535
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

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RD0870691	Aroclor 1254 [CAS:11097-69-1] 500mg/kg in Transformer oil
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DMH-1 500mg

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