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CAS 76750-84-0 4-Amino-2-dimethylamino-6-hydroxypyrimidine Hemihydrate molecular structure lightbox
CAS RN: 76750-84-0

4-Amino-2-dimethylamino-6-hydroxypyrimidine Hemihydrate

  • Product code: SSC-186173
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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: 1g
  • 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 76750-84-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

76750-84-0 / 4-amino-2-(dimethylamino)-1H-pyrimidin-6-one

Standard CAS: 76750-84-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
76750-84-0
Multi CAS
Yes
Molecular Formula
C6H10N4O
Molecular Weight
154.170000
Exact Mass
154.085461
InChI
InChI=1S/C6H10N4O/c1-10(2)6-8-4(7)3-5(11)9-6/h3H,1-2H3,(H3,7,8,9,11)
InChIKey
ZBWZIUPJSKQVQC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
43.6
TPSA
75.01

LogP / Solubility

WLOGP
-0.58
MLOGP
-0.52
XLogP3
-1.2
Consensus LogP
-0.77
Log S (ESOL)
-0.77
Class (ESOL)
Very soluble
Log S (Ali)
-0.4
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.3
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
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)
-4.07

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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