[email protected]
CAS 113214-30-5 5-Methyl-4-phenyl-2-(2-thienyl)thiazole molecular structure lightbox
CAS RN: 113214-30-5

5-Methyl-4-phenyl-2-(2-thienyl)thiazole

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260605 50mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS113214-30-5
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

113214-30-5 / 5-methyl-4-phenyl-2-thiophen-2-yl-1,3-thiazole

5-Methyl-4-phenyl-2-(2-thienyl)thiazole | 5-Methyl-4-phenyl-2-(thiophen-2-yl)thiazole | WAY-639729

Standard CAS: 113214-30-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
113214-30-5
Multi CAS
No
Molecular Formula
C14H11NS2
Molecular Weight
257.400000
Exact Mass
257.033292
SMILES
CC1=C(N=C(S1)C2=CC=CS2)C3=CC=CC=C3
InChI
InChI=1S/C14H11NS2/c1-10-13(11-6-3-2-4-7-11)15-14(17-10)12-8-5-9-16-12/h2-9H,1H3
InChIKey
GJCUAOPBECGQBG-UHFFFAOYSA-N
Synonyms
5-Methyl-4-phenyl-2-(2-thienyl)thiazole 5-Methyl-4-phenyl-2-(thiophen-2-yl)thiazole WAY-639729 MFCD06368612 5-Methyl-4-Phenyl-2-(2-thienyl)-thiazole

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
16
Fraction Csp3
0.07
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
75.6
TPSA
12.89

LogP / Solubility

WLOGP
4.85
MLOGP
4.27
XLogP3
4.4
Consensus LogP
4.51
Log S (ESOL)
-5.05
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.17
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.6
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.85

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us