[email protected]
CAS 15444-20-9 Lysicamine molecular structure lightbox
CAS RN: 15444-20-9

Lysicamine

Product Availability

Choose a grade to view its available package options.

2 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260113 1mg Out of stock Inquiry
Batchno.20251206 5mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS15444-20-9
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

15444-20-9 / 15,16-dimethoxy-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,9,11,13,15-octaen-8-one

Standard CAS: 15444-20-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
15444-20-9
Multi CAS
No
Molecular Formula
C18H13NO3
Molecular Weight
291.300000
Exact Mass
291.089543
SMILES
COC1=C(C2=C3C(=C1)C=CN=C3C(=O)C4=CC=CC=C42)OC
InChI
InChI=1S/C18H13NO3/c1-21-13-9-10-7-8-19-16-14(10)15(18(13)22-2)11-5-3-4-6-12(11)17(16)20/h3-9H,1-2H3
InChIKey
DPBMWJXWUINLQT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
16
Fraction Csp3
0.11
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
83.72
TPSA
48.42

LogP / Solubility

WLOGP
3.46
MLOGP
3.06
XLogP3
3.5
Consensus LogP
3.34
Log S (ESOL)
-4.23
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.45
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.67
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.04

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3

Customers Also Viewed

Get In Touch

Contact Us