Products for Research Use Only

CHF 1255

CAT: 0931-T30875-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T30875-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
146728-52-1
Target
Others
Related Pathways
Others
Bioactivity
CHF 1255 is a potential drug for the treatment of heart failure.
Smiles
O(C)C1=C2C(C[C@@H](N[C@@H]([C@@H](O)C3=CC=C(O)C=C3)C)CC2)=CC=C1OC
Molecular Formula
C21H27NO4
Molecular Weight
357.44
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Chf 1255

structure given in first source; a potential drug for treatment of heart failure; RN refers to ((2R*(S*(R*))-(+-))-isomer

CAS Number146728-52-1
PubChem CID9885094
IUPAC Name4-[2-[(5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-1-hydroxypropyl]phenol
Molecular FormulaC21H27NO4
Molecular Weight357.4
XLogP3.1
Topological Polar Surface Area71
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count26
Formal Charge0
Complexity426
SMILES
CC(C(C1=CC=C(C=C1)O)O)NC2CCC3=C(C2)C=CC(=C3OC)OC
InChI
InChI=1S/C21H27NO4/c1-13(20(24)14-4-8-17(23)9-5-14)22-16-7-10-18-15(12-16)6-11-19(25-2)21(18)26-3/h4-6,8-9,11,13,16,20,22-24H,7,10,12H2,1-3H3
InChIKey
JWRFCMVNMCTPJC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Chf 1255
CAS: 146728-52-1
CID: 9885094
Formula: C21H27NO4
MW: 357.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight357.4
XLogP33.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass357.19400834
Monoisotopic Mass357.19400834
Topological Polar Surface Area71 Ų
Heavy Atom Count26
Formal Charge0
Complexity426
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes