CAS RN: 14367-47-6

mebeverine alcohol

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Batchno.20260305 10mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS14367-47-6
  • Purity/Analytical Methods: >99.0%
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14367-47-6 / 4-[ethyl-[1-(4-methoxyphenyl)propan-2-yl]amino]butan-1-ol

Standard CAS: 14367-47-6 Multi CAS: No

Basic Information

CAS
14367-47-6
Multi CAS
No
Molecular Formula
C16H27NO2
Molecular Weight
265.390000
Exact Mass
265.204179
SMILES
CCN(CCCCO)C(C)CC1=CC=C(C=C1)OC
InChI
InChI=1S/C16H27NO2/c1-4-17(11-5-6-12-18)14(2)13-15-7-9-16(19-3)10-8-15/h7-10,14,18H,4-6,11-13H2,1-3H3
InChIKey
ZGZAPRVKIAFOPL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.62
Rotatable bonds
9
H-bond acceptors
3
H-bond donors
1
Molar refractivity
79.73
TPSA
32.7

LogP / Solubility

WLOGP
2.72
MLOGP
2.4
XLogP3
3
Consensus LogP
2.71
Log S (ESOL)
-2.84
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.7
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.72
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.41

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
2

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