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CAS 5632-29-1 α-Quaterthiophene molecular structure lightbox
CAS RN: 5632-29-1

α-Quaterthiophene

Product Availability

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251102 10mg / 25mg / 100mg / 250mg / 1g Confirm by inquiry Shanghai 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250306 100mg In stock Shanghai Inquiry
Batchno.20250528 1g In stock Shanghai Inquiry
Batchno.20250528 250mg In stock Shanghai Inquiry
  • Product code: ICTQ0078
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5632-29-1 / 2-thiophen-2-yl-5-(5-thiophen-2-ylthiophen-2-yl)thiophene

Standard CAS: 5632-29-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5632-29-1
Multi CAS
Yes
Molecular Formula
C16H10S4
Molecular Weight
330.500000
Exact Mass
329.966535
InChI
InChI=1S/C16H10S4/c1-3-11(17-9-1)13-5-7-15(19-13)16-8-6-14(20-16)12-4-2-10-18-12/h1-10H
InChIKey
FXEJOIFDICYSSO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
20
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
94.26
TPSA
113.0000

LogP / Solubility

WLOGP
6.93
MLOGP
6.12
XLogP3
5.7
Consensus LogP
6.25
Log S (ESOL)
-6.8
Class (ESOL)
Insoluble
Log S (Ali)
-7.28
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.92
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
0.19

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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