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CAS 101012-43-5 2-Thiazolamine, 5-methyl-4-(1-methylethyl)- molecular structure lightbox
CAS RN: 101012-43-5

2-Thiazolamine, 5-methyl-4-(1-methylethyl)-

  • Product code: SSC-001874
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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: 1g, 5g, 0.25g, 0.1g
  • Available purity: ≥95%
  • Inventory rows with stock: 4
  • 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 101012-43-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 5 In Stock Beijing Inquiry
5g ≥95% 3 In Stock Shanghai Inquiry
0.25g ≥95% 2 In Stock Shanghai Inquiry
0.1g ≥95% 1 In Stock Hong Kong Inquiry

101012-43-5 / 5-methyl-4-propan-2-yl-1,3-thiazol-2-amine

5-methyl-4-(propan-2-yl)-1,3-thiazol-2-amine | RefChem:537132 | 839-700-3

Standard CAS: 101012-43-5 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
101012-43-5
Multi CAS
No
Molecular Formula
C7H12N2S
Molecular Weight
156.250000
Exact Mass
156.072120
SMILES
CC1=C(N=C(S1)N)C(C)C
InChI
InChI=1S/C7H12N2S/c1-4(2)6-5(3)10-7(8)9-6/h4H,1-3H3,(H2,8,9)
InChIKey
LTTMCOHWLSCDCV-UHFFFAOYSA-N
Synonyms
5-methyl-4-(propan-2-yl)-1,3-thiazol-2-amine RefChem:537132 839-700-3 2-Amino-4-isopropyl-5-methylthiazole 2-Thiazolamine, 5-methyl-4-(1-methylethyl)-

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.57
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
45.35
TPSA
38.91

LogP / Solubility

WLOGP
2.16
MLOGP
1.89
XLogP3
2.2
Consensus LogP
2.08
Log S (ESOL)
-2.47
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.4
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.59
Class (SILICOS-IT)
Moderately 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)
-2.14

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501

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