Products for Research Use Only

BMH-7

CAT: 0931-T26840-02Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T26840-02Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
379247-14-0
Target
Histamine Receptor, p53
Related Pathways
Apoptosis, GPCR/G Protein, Neuroscience, Immunology/Inflammation
Purity
0.9971
Bioactivity
BMH-7 (Histamine H4 receptor antagonist-2) is a p53 activator with antitumor activity through activation of the p53 pathway.
Smiles
CN(C)CCCNC1=NN2C(=O)C3=C(C=CC=C3)N=C2C2=C1C=CC=C2
Molecular Formula
C20H21N5O
Molecular Weight
347.41
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-[3-(Dimethylamino)propylamino]quinazolino[2,3-a]phthalazin-8-one
CAS Number379247-14-0
PubChem CID1587486
IUPAC Name5-[3-(dimethylamino)propylamino]quinazolino[2,3-a]phthalazin-8-one
Molecular FormulaC20H21N5O
Molecular Weight347.4
XLogP2.3
Topological Polar Surface Area60.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity599
SMILES
CN(C)CCCNC1=NN2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C41
InChI
InChI=1S/C20H21N5O/c1-24(2)13-7-12-21-18-14-8-3-4-9-15(14)19-22-17-11-6-5-10-16(17)20(26)25(19)23-18/h3-6,8-11H,7,12-13H2,1-2H3,(H,21,23)
InChIKey
VYNPQVGFXYNKOX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-[3-(Dimethylamino)propylamino]quinazolino[2,3-a]phthalazin-8-one
CAS: 379247-14-0
CID: 1587486
Formula: C20H21N5O
MW: 347.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight347.4
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass347.17461031
Monoisotopic Mass347.17461031
Topological Polar Surface Area60.3 Ų
Heavy Atom Count26
Formal Charge0
Complexity599
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes