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Mozavaptan

CAT: 0957-S2920-02Size: 100 mgDry Ice: YesHazardous: No
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CAT#:0957-S2920-02Size:100 mg
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Description
Mozavaptan (OPC-31260) is a novel competitive vasopressin receptor antagonist for both V1 and V2 receptors with IC50 of 1.2 μM and 14 nM, respectively.
CAS Number
137975-06-5
Synonyms
OPC-31260
Target
Vasopressin Receptor
Activity
GPCR & G Protein
Molecular Formula
C27H29N3O2
Storage Conditions
2 years -80 in solvent

Chemical Information

Mozavaptan

Mozavaptan is a member of benzamides. It has a role as an aquaretic.

CAS Number137975-06-5
PubChem CID119369
IUPAC NameN-[4-[5-(dimethylamino)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]phenyl]-2-methylbenzamide
Molecular FormulaC27H29N3O2
Molecular Weight427.5
XLogP4.5
Topological Polar Surface Area52.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count32
Formal Charge0
Complexity643
SMILES
CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3CCCC(C4=CC=CC=C43)N(C)C
InChI
InChI=1S/C27H29N3O2/c1-19-9-4-5-10-22(19)26(31)28-21-16-14-20(15-17-21)27(32)30-18-8-13-24(29(2)3)23-11-6-7-12-25(23)30/h4-7,9-12,14-17,24H,8,13,18H2,1-3H3,(H,28,31)
InChIKey
WRNXUQJJCIZICJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mozavaptan
CAS: 137975-06-5
CID: 119369
Formula: C27H29N3O2
MW: 427.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight427.5
XLogP34.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass427.22597718
Monoisotopic Mass427.22597718
Topological Polar Surface Area52.7 Ų
Heavy Atom Count32
Formal Charge0
Complexity643
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
FD71413-01Mozavaptan
NFA47070-01Mozavaptan HCl
HY-18346S-01Mozavaptan-d6
sc-358376Mozavaptan Hydrochloride
A16622-100Mozavaptan 100mg
A16622-25Mozavaptan 25mg
A16622-5Mozavaptan 5mg
C03484-25mgMozavaptan (hydrochloride)

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