Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 0.1g, 0.25g, 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
2244924-46-5 / 4-amino-7-methoxyquinoline-6-carboxamide
Basic Information
CAS
2244924-46-5
Multi CAS
No
Molecular Formula
C11H11N3O2
Molecular Weight
217.220000
Exact Mass
217.085127
SMILES
COC1=CC2=NC=CC(=C2C=C1C(=O)N)N
InChI
InChI=1S/C11H11N3O2/c1-16-10-5-9-6(4-7(10)11(13)15)8(12)2-3-14-9/h2-5H,1H3,(H2,12,14)(H2,13,15)
InChIKey
CNBYCWJBBKXMRD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
10
Fraction Csp3
0.09
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
61.23
TPSA
91.23
LogP / Solubility
WLOGP
0.92
MLOGP
0.82
XLogP3
0.4
Consensus LogP
0.71
Log S (ESOL)
-2.1
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.01
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.08
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)
-3.39
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
-
![CAS 2244927-92-0 [1,1′-Biphenyl]-3,5-dicarboxylic acid, 4′-[(1E)-2-(3′,5′-dicarboxy[1,1′-biphenyl]-4-yl)diazenyl]- molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
[1,1′-Biphenyl]-3,5-dicarboxylic acid, 4′-[(1E)-2-(3′,5′-dicarboxy[1,1′-biphenyl]-4-yl)diazenyl]-
- CAS RN: 2244927-92-0
- Product Code: starshine_CAS2244927-92-0
- Purity/Analytical method: >99.0%
-
5′-(4-formyl-3-hydroxyphenyl)-3,3”-dihydroxy-[1,1′:3′,1”-terphenyl]-4,4”-dicarbaldehyde
- CAS RN: 2244985-34-8
- Product Code: starshine_CAS2244985-34-8
- Purity/Analytical method: >99.0%
-
Urea, N-[trans-4-[(5-cyano-2-pyridinyl)amino]cyclohexyl]-N-[4-(1,6-dihydro-1-methyl-6-oxo-3-pyridinyl)phenyl]-N’-(phenylmethyl)-
- CAS RN: 2244987-03-7
- Product Code: SSC-109634
-
CHMFL-PI3KD-317
- CAS RN: 2244992-76-3
- Product Code: starshine_CAS2244992-76-3
- Purity/Analytical method: >99.0%
-
-
2-(4-((2-fluorophenoxy)methyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
- CAS RN: 2245053-33-0
- Product Code: starshine_CAS2245053-33-0
- Purity/Analytical method: >99.0%
![CAS 2244927-92-0 [1,1′-Biphenyl]-3,5-dicarboxylic acid, 4′-[(1E)-2-(3′,5′-dicarboxy[1,1′-biphenyl]-4-yl)diazenyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2244927-92-0.gif)
![CAS 2244985-34-8 5′-(4-formyl-3-hydroxyphenyl)-3,3”-dihydroxy-[1,1′:3′,1”-terphenyl]-4,4”-dicarbaldehyde molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2244985-34-8.gif)
![CAS 2244987-03-7 Urea, N-[trans-4-[(5-cyano-2-pyridinyl)amino]cyclohexyl]-N-[4-(1,6-dihydro-1-methyl-6-oxo-3-pyridinyl)phenyl]-N’-(phenylmethyl)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2244987-03-7.gif)
