CAS RN: 6367-11-9
AC-HIS-NHME
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.20260209 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS6367-11-9
- Purity/Analytical Methods: >99.0%
6367-11-9 / (2S)-2-acetamido-3-(1H-imidazol-5-yl)-N-methylpropanamide
Basic Information
CAS
6367-11-9
Multi CAS
Yes
Molecular Formula
C9H14N4O2
Molecular Weight
210.230000
Exact Mass
210.111676
InChI
InChI=1S/C9H14N4O2/c1-6(14)13-8(9(15)10-2)3-7-4-11-5-12-7/h4-5,8H,3H2,1-2H3,(H,10,15)(H,11,12)(H,13,14)/t8-/m0/s1
InChIKey
XWLRQKZOVSBKSE-QMMMGPOBSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
5
Fraction Csp3
0.44
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
3
Molar refractivity
53.96
TPSA
86.88
LogP / Solubility
WLOGP
-0.8
MLOGP
-0.7
XLogP3
-0.9
Consensus LogP
-0.8
Log S (ESOL)
-0.62
Class (ESOL)
Very soluble
Log S (Ali)
-0.71
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.84
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
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)
-4.57
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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