CAS RN: 415694-42-7
N,N’-(1,3-Phenylenebis(methylene))bis(furan-2-carboxamide)
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.20260228 | 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS415694-42-7
- Purity/Analytical Methods: >99.0%
415694-42-7 / N-[[3-[(furan-2-carbonylamino)methyl]phenyl]methyl]furan-2-carboxamide
Basic Information
CAS
415694-42-7
Multi CAS
No
Molecular Formula
C18H16N2O4
Molecular Weight
324.300000
Exact Mass
324.111007
InChI
InChI=1S/C18H16N2O4/c21-17(15-6-2-8-23-15)19-11-13-4-1-5-14(10-13)12-20-18(22)16-7-3-9-24-16/h1-10H,11-12H2,(H,19,21)(H,20,22)
InChIKey
OSHVKTUXCUDDMV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
16
Fraction Csp3
0.11
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
2
Molar refractivity
86.2
TPSA
84.48
LogP / Solubility
WLOGP
2.73
MLOGP
2.42
XLogP3
2
Consensus LogP
2.38
Log S (ESOL)
-3.67
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.19
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.76
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.76
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5
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