CAS RN: 439692-69-0

(6-Methyl-thieno[2,3-d]pyrimidin-4-yl)-hydrazine

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250909 100mg / 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS439692-69-0
  • Purity/Analytical Methods: >99.0%
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439692-69-0 / (6-methylthieno[2,3-d]pyrimidin-4-yl)hydrazine

Standard CAS: 439692-69-0 Multi CAS: No

Basic Information

CAS
439692-69-0
Multi CAS
No
Molecular Formula
C7H8N4S
Molecular Weight
180.230000
Exact Mass
180.046967
InChI
InChI=1S/C7H8N4S/c1-4-2-5-6(11-8)9-3-10-7(5)12-4/h2-3H,8H2,1H3,(H,9,10,11)
InChIKey
ACDBTJHVXFDSII-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
9
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
2
Molar refractivity
49.96
TPSA
63.83

LogP / Solubility

WLOGP
1.29
MLOGP
1.13
XLogP3
1.5
Consensus LogP
1.31
Log S (ESOL)
-2.26
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.97
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.02
Class (SILICOS-IT)
Moderately 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)
-2.91

Drug-likeness / Medicinal Chemistry

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

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