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CAS 116436-03-4 2,4-DIAMINO-6-ETHOXYPYRIMIDINE molecular structure lightbox
CAS RN: 116436-03-4

2,4-DIAMINO-6-ETHOXYPYRIMIDINE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260315 250mg / 1g / 5g / 10g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-016476
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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: 0.1g, 0.25g, 1g, 5g
  • Available purity: ＞95%
  • 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 116436-03-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ＞95% 0 Out of Stock Shanghai Inquiry
0.25g ＞95% 0 Out of Stock Shenzhen Inquiry
1g ＞95% 0 Out of Stock Shanghai Inquiry
5g ＞95% 0 Out of Stock Beijing Inquiry

116436-03-4 / 6-ethoxypyrimidine-2,4-diamine

2,4-Diamino-6-ethoxypyrimidine | 6-ethoxypyrimidine-2,4-diamine | 2,4-Pyrimidinediamine, 6-ethoxy-

Standard CAS: 116436-03-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
116436-03-4
Multi CAS
Yes
Molecular Formula
C6H10N4O
Molecular Weight
154.170000
Exact Mass
154.085461
SMILES
CCOC1=NC(=NC(=C1)N)N
InChI
InChI=1S/C6H10N4O/c1-2-11-5-3-4(7)9-6(8)10-5/h3H,2H2,1H3,(H4,7,8,9,10)
InChIKey
MMTAQMVXGXVICH-UHFFFAOYSA-N
Synonyms
2,4-Diamino-6-ethoxypyrimidine 6-ethoxypyrimidine-2,4-diamine 2,4-Pyrimidinediamine, 6-ethoxy- MFCD09031077 NSC9305

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
2
Molar refractivity
42.03
TPSA
87.05

LogP / Solubility

WLOGP
0.04
MLOGP
0.03
XLogP3
0.2
Consensus LogP
0.09
Log S (ESOL)
-1.09
Class (ESOL)
Soluble
Log S (Ali)
-0.85
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.94
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.63

Drug-likeness / Medicinal Chemistry

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

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