Products for Research Use Only
RegisterLogin

ML301

CAT: 0013-GTR19274539-01Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19274539-01Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
ML301 is a small molecule G protein agonist. It can be inhibited by SR142948A, with an IC50 of approximately 63 nM. Additionally, ML301 exhibits the ability to fully compete for binding with [^125I-NT].
CAS Number
1531633-84-7
Smiles
C (N[C@@H] (CC (C) C) C (O) =O) (=O) C1=CN (C (=N1) C2=C (OC) C=CC=C2OC) C=3C4=C (N=CC3) C=C (Cl) C=C4
Molecular Formula
C27H27ClN4O5
Molecular Weight
522.99
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

CID 49837912
CAS Number1531633-84-7
PubChem CID49837912
IUPAC Name(2S)-2-[[1-(7-chloroquinolin-4-yl)-2-(2,6-dimethoxyphenyl)imidazole-4-carbonyl]amino]-4-methylpentanoic acid
Molecular FormulaC27H27ClN4O5
Molecular Weight523.0
XLogP5.1
Topological Polar Surface Area116
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Heavy Atom Count37
Formal Charge0
Complexity776
SMILES
CC(C)C[C@@H](C(=O)O)NC(=O)C1=CN(C(=N1)C2=C(C=CC=C2OC)OC)C3=C4C=CC(=CC4=NC=C3)Cl
InChI
InChI=1S/C27H27ClN4O5/c1-15(2)12-19(27(34)35)31-26(33)20-14-32(21-10-11-29-18-13-16(28)8-9-17(18)21)25(30-20)24-22(36-3)6-5-7-23(24)37-4/h5-11,13-15,19H,12H2,1-4H3,(H,31,33)(H,34,35)/t19-/m0/s1
InChIKey
OUZUXYQXCXYGMX-IBGZPJMESA-N
Chemical Structure
2D Structure
2D structure of CID 49837912
CAS: 1531633-84-7
CID: 49837912
Formula: C27H27ClN4O5
MW: 523.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight523.0
XLogP35.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Exact Mass522.1669977
Monoisotopic Mass522.1669977
Topological Polar Surface Area116 Ų
Heavy Atom Count37
Formal Charge0
Complexity776
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19154904-01ML351
GTR19197037-01ML381
GTR19168636-01ML311
GTR19158427-01ML311
GTR19261563-01ML307
GTR19208954-01ML309
GTR19172959-01ML351
GTR19155982-01ML303
GTR19176637-01ML303

Alternative Products

CatalogName
HY-178725ML301

Popular Products