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CAS 885269-52-3 6-Methylthieno[2,3-d]pyrimidin-4-amine molecular structure lightbox
CAS RN: 885269-52-3

6-Methylthieno[2,3-d]pyrimidin-4-amine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260318 100mg / 250mg / 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS885269-52-3
  • Purity/Analytical Methods: >99.0%
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885269-52-3 / 6-methylthieno[2,3-d]pyrimidin-4-amine

Standard CAS: 885269-52-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
885269-52-3
Multi CAS
No
Molecular Formula
C7H7N3S
Molecular Weight
165.220000
Exact Mass
165.036068
InChI
InChI=1S/C7H7N3S/c1-4-2-5-6(8)9-3-10-7(5)11-4/h2-3H,1H3,(H2,8,9,10)
InChIKey
ACONODTUXUSBFB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.14
H-bond acceptors
4
H-bond donors
1
Molar refractivity
46.56
TPSA
51.8

LogP / Solubility

WLOGP
1.58
MLOGP
1.39
XLogP3
1.6
Consensus LogP
1.52
Log S (ESOL)
-2.47
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.06
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.05
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.6

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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