[email protected]
CAS 1427467-44-4 (R)-2-(7′-octenyl) glycine molecular structure lightbox
CAS RN: 1427467-44-4

(R)-2-(7′-octenyl) glycine

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260422 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS1427467-44-4
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1427467-44-4 / (2R)-2-aminodec-9-enoic acid

Standard CAS: 1427467-44-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1427467-44-4
Multi CAS
No
Molecular Formula
C10H19NO2
Molecular Weight
185.260000
Exact Mass
185.141579
SMILES
C=CCCCCCC[C@H](C(=O)O)N
InChI
InChI=1S/C10H19NO2/c1-2-3-4-5-6-7-8-9(11)10(12)13/h2,9H,1,3-8,11H2,(H,12,13)/t9-/m1/s1
InChIKey
XDHWDJVNBSJHRY-SECBINFHSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.7
Rotatable bonds
8
H-bond acceptors
2
H-bond donors
2
Molar refractivity
53.51
TPSA
63.32

LogP / Solubility

WLOGP
1.92
MLOGP
1.69
XLogP3
0.1
Consensus LogP
1.24
Log S (ESOL)
-1.67
Class (ESOL)
Soluble
Log S (Ali)
-2.47
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.42
Class (SILICOS-IT)
Poorly 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)
-2.48

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2

Customers Also Viewed

Get In Touch

Contact Us