CAS RN: 1137576-41-0
2,5-Dichloro-4-iodopyrimidine
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock1 grade group
- Product code: SSC-013748
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, 10g, 0.1g, 0.25g, 5g, 25g
- Available purity: >95%
- Inventory rows with stock: 6
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | >95% | 5 In Stock | Hong Kong | Inquiry |
| 10g | >95% | 4 In Stock | Hong Kong | Inquiry |
| 0.1g | >95% | 3 In Stock | Shenzhen | Inquiry |
| 0.25g | >95% | 3 In Stock | Hong Kong | Inquiry |
| 5g | >95% | 3 In Stock | Beijing | Inquiry |
| 25g | >95% | 2 In Stock | Shanghai | Inquiry |
1137576-41-0 / 2,5-dichloro-4-iodopyrimidine
2,5-DICHLORO-4-IODOPYRIMIDINE | RefChem:444300 | 837-058-9
Basic Information
CAS
1137576-41-0
Multi CAS
Yes
Molecular Formula
C4HCl2IN2
Molecular Weight
274.870000
Exact Mass
273.856150
SMILES
C1=C(C(=NC(=N1)Cl)I)Cl
InChI
InChI=1S/C4HCl2IN2/c5-2-1-8-4(6)9-3(2)7/h1H
InChIKey
OMRHINHYEHOKCF-UHFFFAOYSA-N
Synonyms
2,5-DICHLORO-4-IODOPYRIMIDINE
RefChem:444300
837-058-9
2,5-dichloro-4-iodo-pyrimidine
MFCD18250122
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
2
Molar refractivity
44.77
TPSA
25.78
LogP / Solubility
WLOGP
2.39
MLOGP
2.11
XLogP3
2.5
Consensus LogP
2.33
Log S (ESOL)
-3.54
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.54
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.43
Class (SILICOS-IT)
Poorly 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)
-2.7
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
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]
H319 (100%): Causes serious eye irritation [Warning 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+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
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![CAS 1137608-69-5 4-[2-Amino-6-[(1R)-1-[4-chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl]-2,2,2-trifluoroethoxy]-4-pyrimidinyl]-L-phenylalanine ethyl ester N-benzoylglycine salt molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1137608-69-5.gif)
