[email protected]
CAS 83259-31-8 2-chloro-5-methylthieno[2,3-d]pyrimidine molecular structure lightbox
CAS RN: 83259-31-8

2-chloro-5-methylthieno[2,3-d]pyrimidine

  • Product code: SSC-191140
GET A QUOTE
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: 1
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 83259-31-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 1 In Stock Shenzhen Inquiry
0.25g ≥95% 0 Out of Stock Hong Kong Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

83259-31-8 / 2-chloro-5-methylthieno[2,3-d]pyrimidine

Standard CAS: 83259-31-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
83259-31-8
Multi CAS
No
Molecular Formula
C7H5CLN2S
Molecular Weight
184.650000
Exact Mass
183.986197
InChI
InChI=1S/C7H5ClN2S/c1-4-3-11-6-5(4)2-9-7(8)10-6/h2-3H,1H3
InChIKey
MPEUVNBNQLDAON-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.14
H-bond acceptors
3
Molar refractivity
47.16
TPSA
25.78

LogP / Solubility

WLOGP
2.65
MLOGP
2.33
XLogP3
2.9
Consensus LogP
2.63
Log S (ESOL)
-3.26
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.99
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.06
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.96

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us