Products for Research Use Only

SR 27897

CAT: 0607-B6965-50Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0607-B6965-50Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
CCK1 receptor antagonist
CAS Number
136381-85-6
Product Name Alternative
2-(2-((4-(2-chlorophenyl)thiazol-2-yl)carbamoyl)-1H-indol-1-yl)acetic acid
Field of Research
GPCR G protein CCK1 Receptors
Purity
0.98
Form
Off White solid
Solubility
<20.59mg/ml in DMSO
Smiles
ClC1=CC=CC=C1C2=CSC(NC(C3=CC4=CC=CC=C4N3CC(O)=O)=O)=N2
Molecular Formula
C20H14ClN3O3S
Molecular Weight
411.86
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Lintitript

2-[2-[[[4-(2-chlorophenyl)-2-thiazolyl]amino]-oxomethyl]-1-indolyl]acetic acid is an indolyl carboxylic acid.

CAS Number136381-85-6
PubChem CID122077
IUPAC Name2-[2-[[4-(2-chlorophenyl)-1,3-thiazol-2-yl]carbamoyl]indol-1-yl]acetic acid
Molecular FormulaC20H14ClN3O3S
Molecular Weight411.9
XLogP4.5
Topological Polar Surface Area112
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity595
SMILES
C1=CC=C2C(=C1)C=C(N2CC(=O)O)C(=O)NC3=NC(=CS3)C4=CC=CC=C4Cl
InChI
InChI=1S/C20H14ClN3O3S/c21-14-7-3-2-6-13(14)15-11-28-20(22-15)23-19(27)17-9-12-5-1-4-8-16(12)24(17)10-18(25)26/h1-9,11H,10H2,(H,25,26)(H,22,23,27)
InChIKey
ILNRQFBVVQUOLP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lintitript
CAS: 136381-85-6
CID: 122077
Formula: C20H14ClN3O3S
MW: 411.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight411.9
XLogP34.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass411.0444402
Monoisotopic Mass411.0444402
Topological Polar Surface Area112 Ų
Heavy Atom Count28
Formal Charge0
Complexity595
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