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CAS 882847-21-4 FMOC-4-CYCLOHEXYL-PIPERIDINE-4-CARBOXYLIC ACID molecular structure lightbox
CAS RN: 882847-21-4

FMOC-4-CYCLOHEXYL-PIPERIDINE-4-CARBOXYLIC ACID

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250908 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS882847-21-4
  • Purity/Analytical Methods: >99.0%
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882847-21-4 / 4-cyclohexyl-1-(9H-fluoren-9-ylmethoxycarbonyl)piperidine-4-carboxylic acid

Standard CAS: 882847-21-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
882847-21-4
Multi CAS
Yes
Molecular Formula
C27H31NO4
Molecular Weight
433.500000
Exact Mass
433.225308
InChI
InChI=1S/C27H31NO4/c29-25(30)27(19-8-2-1-3-9-19)14-16-28(17-15-27)26(31)32-18-24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h4-7,10-13,19,24H,1-3,8-9,14-18H2,(H,29,30)
InChIKey
PPMKHBWXFHVDEU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
12
Fraction Csp3
0.48
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
1
Molar refractivity
122.52
TPSA
66.84

LogP / Solubility

WLOGP
5.68
MLOGP
5.03
XLogP3
5.8
Consensus LogP
5.5
Log S (ESOL)
-6.12
Class (ESOL)
Insoluble
Log S (Ali)
-7.22
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.67
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.33

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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