[email protected]
CAS 1219806-47-9 9-Amino-1,2,3,4-tetrahydroacridin-1-ol-d3 molecular structure lightbox
CAS RN: 1219806-47-9

9-Amino-1,2,3,4-tetrahydroacridin-1-ol-d3

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260326 5mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS1219806-47-9
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1219806-47-9 / 9-amino-1,2,2-trideuterio-3,4-dihydroacridin-1-ol

Standard CAS: 1219806-47-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1219806-47-9
Multi CAS
No
Molecular Formula
C13H14N2O
Molecular Weight
217.280000
Exact Mass
217.129443
SMILES
[2H]C1(CCC2=NC3=CC=CC=C3C(=C2C1([2H])O)N)[2H]
InChI
InChI=1S/C13H14N2O/c14-13-8-4-1-2-5-9(8)15-10-6-3-7-11(16)12(10)13/h1-2,4-5,11,16H,3,6-7H2,(H2,14,15)/i7D2,11D
InChIKey
HLVVITIHAZBPKB-XGWWUZNLSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
10
Fraction Csp3
0.31
H-bond acceptors
3
H-bond donors
2
Molar refractivity
64.05
TPSA
59.14

LogP / Solubility

WLOGP
2.19
MLOGP
1.93
XLogP3
1.4
Consensus LogP
1.84
Log S (ESOL)
-3.01
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.9
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.87
Class (SILICOS-IT)
Moderately 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)
-2.47

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us