CAS RN: 143086-32-2
N-(1-METHYL-3-PHENYLPROPYL)-N-VALERAMIDE
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.20250420 | 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS143086-32-2
- Purity/Analytical Methods: >99.0%
143086-32-2 / N-(4-phenylbutan-2-yl)pentanamide
Basic Information
CAS
143086-32-2
Multi CAS
No
Molecular Formula
C15H23NO
Molecular Weight
233.350000
Exact Mass
233.177964
SMILES
CCCCC(=O)NC(C)CCC1=CC=CC=C1
InChI
InChI=1S/C15H23NO/c1-3-4-10-15(17)16-13(2)11-12-14-8-6-5-7-9-14/h5-9,13H,3-4,10-12H2,1-2H3,(H,16,17)
InChIKey
PLWKOZGQPUWQNJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.53
Rotatable bonds
7
H-bond acceptors
1
H-bond donors
1
Molar refractivity
71.89
TPSA
29.1
LogP / Solubility
WLOGP
3.31
MLOGP
2.92
XLogP3
3.7
Consensus LogP
3.31
Log S (ESOL)
-3.17
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.87
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.77
Class (SILICOS-IT)
Slightly 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)
-1.79
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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