[email protected]
CAS 57906-85-1 (-)-Corynoxidine molecular structure lightbox
CAS RN: 57906-85-1

(-)-Corynoxidine

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250828 5mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS57906-85-1
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

57906-85-1 / 2,3,9,10-tetramethoxy-7-oxido-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium

Standard CAS: 57906-85-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
57906-85-1
Multi CAS
Yes
Molecular Formula
C21H25NO5
Molecular Weight
371.400000
Exact Mass
371.173273
InChI
InChI=1S/C21H25NO5/c1-24-18-6-5-13-9-17-15-11-20(26-3)19(25-2)10-14(15)7-8-22(17,23)12-16(13)21(18)27-4/h5-6,10-11,17H,7-9,12H2,1-4H3/t17-,22-/m0/s1
InChIKey
QYEMUDHNCZHUKC-JTSKRJEESA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
12
Fraction Csp3
0.43
Rotatable bonds
4
H-bond acceptors
5
Molar refractivity
101.44
TPSA
59.98

LogP / Solubility

WLOGP
3.39
MLOGP
3
XLogP3
2.7
Consensus LogP
3.03
Log S (ESOL)
-4.34
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.05
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.37
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.58

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

Customers Also Viewed

Get In Touch

Contact Us