[email protected]
CAS 1190319-80-2 7-AMINO-4-BROMO-1H-INDAZOLE molecular structure lightbox
CAS RN: 1190319-80-2

7-AMINO-4-BROMO-1H-INDAZOLE

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260105 100mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1190319-80-2
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1190319-80-2 / 4-bromo-1H-indazol-7-amine

4-BROMO-1H-INDAZOL-7-AMINE | 7-AMINO-4-BROMO-1H-INDAZOLE | MFCD12963529

Standard CAS: 1190319-80-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1190319-80-2
Multi CAS
No
Molecular Formula
C7H6BrN3
Molecular Weight
212.050000
Exact Mass
210.974510
SMILES
C1=CC(=C2C=NNC2=C1N)Br
InChI
InChI=1S/C7H6BrN3/c8-5-1-2-6(9)7-4(5)3-10-11-7/h1-3H,9H2,(H,10,11)
InChIKey
CZHGKGRFBMFAFI-UHFFFAOYSA-N
Synonyms
4-BROMO-1H-INDAZOL-7-AMINE 7-AMINO-4-BROMO-1H-INDAZOLE MFCD12963529 1H-Indazol-7-amine, 4-bromo- DTXSID001311808

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
2
H-bond donors
2
Molar refractivity
48.21
TPSA
54.7

LogP / Solubility

WLOGP
1.91
MLOGP
1.68
XLogP3
1.6
Consensus LogP
1.73
Log S (ESOL)
-2.96
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.68
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.62
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)
-2.66

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us