[email protected]
CAS 1030626-93-7 5-Chloro-8-iodo-[1,2,4]triazolo[1,5-a]pyridine molecular structure lightbox
CAS RN: 1030626-93-7

5-Chloro-8-iodo-[1,2,4]triazolo[1,5-a]pyridine

  • Product code: SSC-004511
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: 1g, 0.1g, 0.25g
  • Available purity: ≥98%
  • 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 1030626-93-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 3 In Stock Beijing Inquiry
0.1g ≥98% 0 Out of Stock Hong Kong Inquiry
0.25g ≥98% 0 Out of Stock Shenzhen Inquiry

1030626-93-7 / 5-chloro-8-iodo-[1,2,4]triazolo[1,5-a]pyridine

5-chloro-8-iodo-[1,2,4]triazolo[1,5-a]pyridine | MFCD21364530 | [1,2,4]triazolo[1,5-a]pyridine, 5-chloro-8-iodo-

Standard CAS: 1030626-93-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1030626-93-7
Multi CAS
No
Molecular Formula
C6H3ClIN3
Molecular Weight
279.460000
Exact Mass
278.906020
SMILES
C1=C(C2=NC=NN2C(=C1)Cl)I
InChI
InChI=1S/C6H3ClIN3/c7-5-2-1-4(8)6-9-3-10-11(5)6/h1-3H
InChIKey
BPGWWRPPLVFBGK-UHFFFAOYSA-N
Synonyms
5-chloro-8-iodo-[1,2,4]triazolo[1,5-a]pyridine MFCD21364530 [1,2,4]triazolo[1,5-a]pyridine, 5-chloro-8-iodo- SCHEMBL1044933 BPGWWRPPLVFBGK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
3
Molar refractivity
50.71
TPSA
30.19

LogP / Solubility

WLOGP
1.99
MLOGP
1.76
XLogP3
2.4
Consensus LogP
2.05
Log S (ESOL)
-3.43
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.29
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.13
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)
-3.01

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us