CAS RN: 2267330-75-4
6-Quinoxalinamine, 5-(dimethylphosphinyl)-
- Product code: SSC-110641
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.25g, 0.1g, 1g
- Available purity: >95%
- Inventory rows with stock: 1
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
2267330-75-4 / 5-dimethylphosphorylquinoxalin-6-amine
Basic Information
CAS
2267330-75-4
Multi CAS
No
Molecular Formula
C10H12N3OP
Molecular Weight
221.200000
Exact Mass
221.071799
SMILES
CP(=O)(C)C1=C(C=CC2=NC=CN=C21)N
InChI
InChI=1S/C10H12N3OP/c1-15(2,14)10-7(11)3-4-8-9(10)13-6-5-12-8/h3-6H,11H2,1-2H3
InChIKey
HFPASWSTLSWIEI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
10
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
63.04
TPSA
68.87
LogP / Solubility
WLOGP
1.46
MLOGP
1.29
XLogP3
0.1
Consensus LogP
0.95
Log S (ESOL)
-2.56
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.43
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.43
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.03
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
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![CAS 2270178-41-9 2,2′-Bioxazole, 4,4′,5,5′-tetrahydro-4,4′-bis[(1S)-1-methylpropyl]-, (4R,4’R)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2270178-41-9.gif)
