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CAS 115063-92-8 Thieno[3,2-b]pyridin-6-amine (9CI) molecular structure lightbox
CAS RN: 115063-92-8

Thieno[3,2-b]pyridin-6-amine (9CI)

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250909 250mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS115063-92-8
  • Purity/Analytical Methods: >99.0%
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115063-92-8 / thieno[3,2-b]pyridin-6-amine

Thieno[3,2-b]pyridin-6-amine | MFCD14706796 | Thieno[3,2-b]pyridin-6-amine (9CI)

Standard CAS: 115063-92-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
115063-92-8
Multi CAS
Yes
Molecular Formula
C7H6N2S
Molecular Weight
150.200000
Exact Mass
150.025169
SMILES
C1=CSC2=C1N=CC(=C2)N
InChI
InChI=1S/C7H6N2S/c8-5-3-7-6(9-4-5)1-2-10-7/h1-4H,8H2
InChIKey
ZEPHVTQYZYJBCT-UHFFFAOYSA-N
Synonyms
Thieno[3,2-b]pyridin-6-amine MFCD14706796 Thieno[3,2-b]pyridin-6-amine (9CI) 6-Aminothieno[3,2-b]pyridine SCHEMBL10650166

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
3
H-bond donors
1
Molar refractivity
44.03
TPSA
38.91

LogP / Solubility

WLOGP
1.88
MLOGP
1.65
XLogP3
1.3
Consensus LogP
1.61
Log S (ESOL)
-2.62
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.15
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.2
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)
-2.3

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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