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CAS 1197953-49-3 2,5-dichloro-N-(2-(diMethylphosphoryl)phenyl)pyriMidin-4-aMine molecular structure lightbox
CAS RN: 1197953-49-3

2,5-dichloro-N-(2-(diMethylphosphoryl)phenyl)pyriMidin-4-aMine

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13 package records11 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250515 1g In stock Inquiry
Batchno.20250322 250mg In stock Inquiry
Batchno.20260313 25g In stock Inquiry
Batchno.20250618 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250503 100g Out of stock Inquiry
Batchno.20250814 10g In stock Shanghai Inquiry
Batchno.20251023 1g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260113 250mg In stock Shanghai, Wuhan, Chengdu Inquiry
Batchno.20260404 250mg / 1g / 5g / 10g / 25g / 100g Confirm by inquiry Shanghai, Shandong Inquiry
Batchno.20260521 25g In stock Shanghai Inquiry
Batchno.20250113 5g In stock Shanghai, Tianjin Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260224 250mg Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250709 250mg / 1g / 5g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: SSC-020527
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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, 0.25g, 5g, 10g, 25g
  • Available purity: ≥97%
  • Inventory rows with stock: 3
  • 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 1197953-49-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 5 In Stock Shanghai Inquiry
0.25g ≥97% 2 In Stock Shanghai Inquiry
5g ≥97% 1 In Stock Beijing Inquiry
10g ≥97% 0 Out of Stock Hong Kong Inquiry
25g ≥97% 0 Out of Stock Hong Kong Inquiry

1197953-49-3 / 2,5-dichloro-N-(2-dimethylphosphorylphenyl)pyrimidin-4-amine

(2-((2,5-Dichloropyrimidin-4-yl)amino)phenyl)dimethylphosphine oxide | RefChem:394735 | 961-672-7

Standard CAS: 1197953-49-3 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1197953-49-3
Multi CAS
Yes
Molecular Formula
C12H12Cl2N3OP
Molecular Weight
316.120000
Exact Mass
315.009504
SMILES
CP(=O)(C)C1=CC=CC=C1NC2=NC(=NC=C2Cl)Cl
InChI
InChI=1S/C12H12Cl2N3OP/c1-19(2,18)10-6-4-3-5-9(10)16-11-8(13)7-15-12(14)17-11/h3-7H,1-2H3,(H,15,16,17)
InChIKey
XIKUAKVCJMVXCI-UHFFFAOYSA-N
Synonyms
(2-((2,5-Dichloropyrimidin-4-yl)amino)phenyl)dimethylphosphine oxide RefChem:394735 961-672-7 2,5-dichloro-N-(2-(dimethylphosphoryl)phenyl)pyrimidin-4-amine MFCD29477700

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
12
Fraction Csp3
0.17
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
1
Molar refractivity
80.87
TPSA
54.88

LogP / Solubility

WLOGP
3.78
MLOGP
3.34
XLogP3
3.2
Consensus LogP
3.44
Log S (ESOL)
-4.45
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.88
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.21
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.97

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement Codes
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501

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