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CAS 766545-20-4 2-CHLORO-5,6,7,8-TETRAHYDRO-1,6-NAPHTHYRIDINE HYDROCHLORIDE molecular structure lightbox
CAS RN: 766545-20-4

2-CHLORO-5,6,7,8-TETRAHYDRO-1,6-NAPHTHYRIDINE HYDROCHLORIDE

  • Product code: SSC-186103
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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: 1g, 5g, 10g, 25g, 100g
  • Available purity: >96%
  • Inventory rows with stock: 8
  • 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 766545-20-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 1 In Stock Beijing Inquiry
1g >96% 1 In Stock Hong Kong Inquiry
5g -- 1 In Stock Beijing Inquiry
5g >96% 1 In Stock Beijing Inquiry
10g -- 1 In Stock Shanghai Inquiry
10g >96% 1 In Stock Beijing Inquiry
25g >96% 1 In Stock Shenzhen Inquiry
100g >96% 1 In Stock Shenzhen Inquiry
25g -- 0 Out of Stock Shenzhen Inquiry
100g -- 0 Out of Stock Shenzhen Inquiry

766545-20-4 / 2-chloro-5,6,7,8-tetrahydro-1,6-naphthyridine;hydrochloride

Standard CAS: 766545-20-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
766545-20-4
Multi CAS
Yes
Molecular Formula
C8H10CL2N2
Molecular Weight
205.080000
Exact Mass
204.022104
InChI
InChI=1S/C8H9ClN2.ClH/c9-8-2-1-6-5-10-4-3-7(6)11-8;/h1-2,10H,3-5H2;1H
InChIKey
FRACHJCOMOVESL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.38
H-bond acceptors
2
H-bond donors
1
Molar refractivity
51.91
TPSA
24.92

LogP / Solubility

WLOGP
1.8
MLOGP
1.59
XLogP3
1.8
Consensus LogP
1.73
Log S (ESOL)
-2.62
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.54
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.49
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)
-2.69

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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