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CAS 14643-77-7 2-Amino-3-(4-methyl-5-thiazolyl)propionic Acid molecular structure lightbox
CAS RN: 14643-77-7

2-Amino-3-(4-methyl-5-thiazolyl)propionic Acid

  • Product code: SSC-057471
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 14643-77-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 1 In Stock Beijing Inquiry
0.25g ≥95% 1 In Stock Beijing Inquiry
1g ≥95% 1 In Stock Shenzhen Inquiry

14643-77-7 / 2-amino-3-(4-methyl-1,3-thiazol-5-yl)propanoic acid

Standard CAS: 14643-77-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
14643-77-7
Multi CAS
No
Molecular Formula
C7H10N2O2S
Molecular Weight
186.230000
Exact Mass
186.046299
SMILES
CC1=C(SC=N1)CC(C(=O)O)N
InChI
InChI=1S/C7H10N2O2S/c1-4-6(12-3-9-4)2-5(8)7(10)11/h3,5H,2,8H2,1H3,(H,10,11)
InChIKey
SWIVOHPEBLNTMO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
5
Fraction Csp3
0.43
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
2
Molar refractivity
46.17
TPSA
76.21

LogP / Solubility

WLOGP
0.41
MLOGP
0.36
XLogP3
-1.9
Consensus LogP
-0.38
Log S (ESOL)
-1.36
Class (ESOL)
Soluble
Log S (Ali)
-1.38
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.57
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.57

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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