Products for Research Use Only
RegisterLogin

Cimetidine

CAT: 1410-M14785-02Size: 1 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1410-M14785-02Size:1 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Cimetidine is a histamine-2 (H2) receptor antagonist.
CAS Number
51481-61-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
252.34
Molecular Formula
C10H16N6S
Notes
Research use only, not for human use.
Receptor
H2 receptor

Chemical Information

Cimetidine

Cimetidine is a member of the class of guanidines that consists of guanidine carrying a methyl substituent at position 1, a cyano group at position 2 and a 2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl group at position 3. It is a H2-receptor antagonist that inhibits the production of acid in stomach. It has a role as an analgesic, a H2-receptor antagonist, an anti-ulcer drug, a P450 inhibitor and an adjuvant. It is a nitrile, an aliphatic sulfide, a member of guanidines and a member of imidazoles.

CAS Number51481-61-9
PubChem CID2756
IUPAC Name1-cyano-2-methyl-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine
Molecular FormulaC10H16N6S
Molecular Weight252.34
XLogP0.4
Topological Polar Surface Area114
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count17
Formal Charge0
Complexity296
SMILES
CC1=C(N=CN1)CSCCNC(=NC)NC#N
InChI
InChI=1S/C10H16N6S/c1-8-9(16-7-15-8)5-17-4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)
InChIKey
AQIXAKUUQRKLND-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cimetidine
CAS: 51481-61-9
CID: 2756
Formula: C10H16N6S
MW: 252.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight252.34
XLogP30.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass252.11571571
Monoisotopic Mass252.11571571
Topological Polar Surface Area114 Ų
Heavy Atom Count17
Formal Charge0
Complexity296
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

Alternative Products

CatalogName
B1557-5.1Cimetidine

Popular Products