CAS RN: 29821-63-4
6-Chloro-2-quinoxalinecarboxylic 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.20250513 | 100mg / 250mg / 500mg | Out of stock | 1 business days | Inquiry |
- Product code: starshine_CAS29821-63-4
- Purity/Analytical Methods: >99.0%
29821-63-4 / 6-chloroquinoxaline-2-carboxylic acid
Basic Information
CAS
29821-63-4
Multi CAS
Yes
Molecular Formula
C9H5CLN2O2
Molecular Weight
208.600000
Exact Mass
208.003955
InChI
InChI=1S/C9H5ClN2O2/c10-5-1-2-6-7(3-5)11-4-8(12-6)9(13)14/h1-4H,(H,13,14)
InChIKey
BYBZIRPDXYNMKC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
10
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
51.51
TPSA
63.08
LogP / Solubility
WLOGP
1.98
MLOGP
1.74
XLogP3
2.3
Consensus LogP
2.01
Log S (ESOL)
-2.84
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.7
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.78
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)
-2.59
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
-
4-BENZYLOXY-3-AMINO-A-[-BENZYL-N-(1-METHYL-2P-METHOXY PHENYL ETHER) AMINO-METHYL BENZYL ALCOHOL
- CAS RN: 2982-54-9
- Product Code: SSC-133015
-
ethyl ester- 8-amino- Octanoic acid, hydrochloride (1:1)
- CAS RN: 29833-31-6
- Product Code: starshine_CAS29833-31-6
- Purity/Analytical method: >99.0%
-
11-amino Undecanoic acid methyl ester hydrochloride (1:1)
- CAS RN: 29833-32-7
- Product Code: SSC-133049
