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CAS 1005-38-5 4-Amino-6-chloro-2-(methylthio)pyrimidine molecular structure lightbox
CAS RN: 1005-38-5

4-Amino-6-chloro-2-(methylthio)pyrimidine

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250815 100g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20250305 10g In stock Shanghai, Shenzhen Inquiry
Batchno.20250922 1g In stock Shanghai, Shenzhen Inquiry
Batchno.20260514 25g In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20260319 500g In stock Shanghai Inquiry
Batchno.20260311 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260222 5g / 25g / 100g / 500g Confirm by inquiry Shandong, Shanghai 8-10 business days Inquiry
  • Product code: SSC-001076
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g, 5g, 10g, 25g
  • Available purity: >97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1005-38-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 0 Out of Stock Beijing Inquiry
5g >97% 0 Out of Stock Hong Kong Inquiry
10g >97% 0 Out of Stock Shanghai Inquiry
25g >97% 0 Out of Stock Hong Kong Inquiry

1005-38-5 / 6-chloro-2-methylsulfanylpyrimidin-4-amine

4-Pyrimidinamine, 6-chloro-2-(methylthio)- | 4-Amino-6-chloro-2-methylthiopyrimidine | 6-Chloro-2-methylthiopyrimidin-4-ylamine

Standard CAS: 1005-38-5 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1005-38-5
Multi CAS
Yes
Molecular Formula
C5H6ClN3S
Molecular Weight
175.640000
Exact Mass
174.997096
SMILES
CSC1=NC(=CC(=N1)Cl)N
InChI
InChI=1S/C5H6ClN3S/c1-10-5-8-3(6)2-4(7)9-5/h2H,1H3,(H2,7,8,9)
InChIKey
ISUXMAHVLFRZQU-UHFFFAOYSA-N
Synonyms
4-Pyrimidinamine, 6-chloro-2-(methylthio)- 4-Amino-6-chloro-2-methylthiopyrimidine 6-Chloro-2-methylthiopyrimidin-4-ylamine P8SND49KYK EINECS 213-734-3

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
43.24
TPSA
51.8

LogP / Solubility

WLOGP
1.43
MLOGP
1.26
XLogP3
1.7
Consensus LogP
1.46
Log S (ESOL)
-2.21
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.04
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.11
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)
-2.77

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)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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