CAS RN: 66092-63-5
6-Bromo-4-Nitronicotinic Acid
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260319 | 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS66092-63-5
- Purity/Analytical Methods: >99.0%
66092-63-5 / 6-bromo-4-nitropyridine-3-carboxylic acid
Basic Information
CAS
66092-63-5
Multi CAS
Yes
Molecular Formula
BC6H3O4Rn2
Molecular Weight
247.000000
Exact Mass
245.927620
InChI
InChI=1S/C6H3BrN2O4/c7-5-1-4(9(12)13)3(2-8-5)6(10)11/h1-2H,(H,10,11)
InChIKey
DXCCKVXDMGBPDN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
45.55
TPSA
93.33
LogP / Solubility
WLOGP
1.45
MLOGP
1.28
XLogP3
1.2
Consensus LogP
1.31
Log S (ESOL)
-2.49
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.63
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.71
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.2
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
-
-
4-(METHYLAMINO)-1-(3-PYRIDYL)-1-BUTANONE DIHYDROCHLORIDE
- CAS RN: 66093-90-1
- Product Code: SSC-175747
-
BENZYL N-(6-AMINOHEXYL)CARBAMATE HYDROCHLORIDE
- CAS RN: 66095-18-9
- Product Code: starshine_CAS66095-18-9
- Purity/Analytical method: >99.0%
-
-
N-[4-(Methylamino)benzoyl]-L-glutamic acid zinc salt
- CAS RN: 66104-81-2
- Product Code: starshine_CAS66104-81-2
- Purity/Analytical method: >99.0%
-
4-Bromophenyl triflate
- CAS RN: 66107-30-0
- Product Code: starshine_CAS66107-30-0
- Purity/Analytical method: >99.0%
![CAS 66104-81-2 N-[4-(Methylamino)benzoyl]-L-glutamic acid zinc salt molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/66104-81-2.gif)
