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CAS 37804-11-8 3-AMINO-6-CHLORO-5-DIMETHYLAMINO-N-2-PYRIDINYLPYRAZINECARBOXAMIDE HYDROCHLORIDE molecular structure lightbox
CAS RN: 37804-11-8

3-AMINO-6-CHLORO-5-DIMETHYLAMINO-N-2-PYRIDINYLPYRAZINECARBOXAMIDE HYDROCHLORIDE

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260402 10mg In stock Inquiry
Batchno.20250112 1mg Out of stock Inquiry
Batchno.20251117 25mg In stock Inquiry
Batchno.20260210 50mg In stock Inquiry
Batchno.20251229 5mg In stock Inquiry
  • Product code: starshine_CAS37804-11-8
  • Purity/Analytical Methods: >99.0%
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37804-11-8 / 3-amino-6-chloro-5-(dimethylamino)-N-pyridin-2-ylpyrazine-2-carboxamide

Standard CAS: 37804-11-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
37804-11-8
Multi CAS
Yes
Molecular Formula
C12H13CLN6O
Molecular Weight
292.720000
Exact Mass
292.083937
InChI
InChI=1S/C12H13ClN6O.ClH/c1-19(2)11-9(13)17-8(10(14)18-11)12(20)16-7-4-3-5-15-6-7;/h3-6H,1-2H3,(H2,14,18)(H,16,20);1H
InChIKey
CXIHLPLRTFPHKX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.17
Rotatable bonds
3
H-bond acceptors
6
H-bond donors
2
Molar refractivity
77.97
TPSA
97.03

LogP / Solubility

WLOGP
1.43
MLOGP
1.27
XLogP3
1.8
Consensus LogP
1.5
Log S (ESOL)
-2.8
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.99
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.11
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.49

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5

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