[email protected]
CAS 1206969-56-3 7-Fluoro-4-methoxybenzo[d]thiazol-2-amine molecular structure lightbox
CAS RN: 1206969-56-3

7-Fluoro-4-methoxybenzo[d]thiazol-2-amine

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251028 100mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1206969-56-3
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1206969-56-3 / 7-fluoro-4-methoxy-1,3-benzothiazol-2-amine

7-fluoro-4-methoxybenzo[d]thiazol-2-amine | 7-fluoro-4-methoxy-1,3-benzothiazol-2-amine | SCHEMBL21902256

Standard CAS: 1206969-56-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1206969-56-3
Multi CAS
No
Molecular Formula
C8H7FN2OS
Molecular Weight
198.220000
Exact Mass
198.026312
SMILES
COC1=C2C(=C(C=C1)F)SC(=N2)N
InChI
InChI=1S/C8H7FN2OS/c1-12-5-3-2-4(9)7-6(5)11-8(10)13-7/h2-3H,1H3,(H2,10,11)
InChIKey
SWKWLSYEZOBJPI-UHFFFAOYSA-N
Synonyms
7-fluoro-4-methoxybenzo[d]thiazol-2-amine 7-fluoro-4-methoxy-1,3-benzothiazol-2-amine SCHEMBL21902256 MFCD14585423 7-Fluoro-4-methoxy-2-benzothiazolamine

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
9
Fraction Csp3
0.12
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
50.54
TPSA
48.14

LogP / Solubility

WLOGP
2.03
MLOGP
1.78
XLogP3
2.1
Consensus LogP
1.97
Log S (ESOL)
-2.79
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.65
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.75
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)
-2.49

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