[email protected]
CAS 75782-81-9 3-Amino-5-phenylthiophene molecular structure lightbox
CAS RN: 75782-81-9

3-Amino-5-phenylthiophene

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250605 100mg / 250mg Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS75782-81-9
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

75782-81-9 / 5-phenylthiophen-3-amine

Standard CAS: 75782-81-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
75782-81-9
Multi CAS
No
Molecular Formula
C10H9NS
Molecular Weight
175.250000
Exact Mass
175.045570
InChI
InChI=1S/C10H9NS/c11-9-6-10(12-7-9)8-4-2-1-3-5-8/h1-7H,11H2
InChIKey
GQNDKVSFMBAOLF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
11
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
54.17
TPSA
26.02

LogP / Solubility

WLOGP
3
MLOGP
2.63
XLogP3
2.6
Consensus LogP
2.74
Log S (ESOL)
-3.43
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.16
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.41
Class (SILICOS-IT)
Poorly 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)
-1.66

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us