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CAS 1187930-23-9 5,6,7,8-Tetrahydro-quinolin-5-ylamine dihydrochloride molecular structure lightbox
CAS RN: 1187930-23-9

5,6,7,8-Tetrahydro-quinolin-5-ylamine dihydrochloride

  • Product code: SSC-018826
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: >98%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1187930-23-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >98% 1 In Stock Shanghai Inquiry
0.25g >98% 1 In Stock Beijing Inquiry
1g >98% 1 In Stock Hong Kong Inquiry
5g >98% 0 Out of Stock Beijing Inquiry

1187930-23-9 / 5,6,7,8-tetrahydroquinolin-5-amine;dihydrochloride

5,6,7,8-tetrahydroquinolin-5-amine dihydrochloride | 5,6,7,8-TETRAHYDRO-QUINOLIN-5-YLAMINE DIHYDROCHLORIDE | MFCD12913787

Standard CAS: 1187930-23-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1187930-23-9
Multi CAS
No
Molecular Formula
C9H14Cl2N2
Molecular Weight
221.120000
Exact Mass
220.053404
SMILES
C1CC(C2=C(C1)N=CC=C2)N.Cl.Cl
InChI
InChI=1S/C9H12N2.2ClH/c10-8-4-1-5-9-7(8)3-2-6-11-9;;/h2-3,6,8H,1,4-5,10H2;2*1H
InChIKey
CUZNREDMYVDIMR-UHFFFAOYSA-N
Synonyms
5,6,7,8-tetrahydroquinolin-5-amine dihydrochloride 5,6,7,8-TETRAHYDRO-QUINOLIN-5-YLAMINE DIHYDROCHLORIDE MFCD12913787 5,6,7,8-Tetrahydro-5-quinolinamine dihydrochloride 5,6,7,8-tetrahydroquinolin-5-amine;dihydrochloride

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.44
H-bond acceptors
2
H-bond donors
1
Molar refractivity
58.6
TPSA
38.91

LogP / Solubility

WLOGP
2.26
MLOGP
1.99
XLogP3
2.26
Consensus LogP
2.17
Log S (ESOL)
-2.98
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.01
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-2.97
Class (SILICOS-IT)
Moderately 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)
-2.46

Drug-likeness / Medicinal Chemistry

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

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