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CAS 140924-50-1 (DHQ)2PHAL molecular structure lightbox
CAS RN: 140924-50-1

(DHQ)2PHAL

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16 package records14 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250713 100g Out of stock Inquiry
Batchno.20250326 10g In stock Inquiry
Batchno.20250328 1g In stock Inquiry
Batchno.20250603 25g In stock Inquiry
Batchno.20260126 500mg In stock Inquiry
Batchno.20250929 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250328 100g Out of stock 5-7 business days Inquiry
Batchno.20260605 1g In stock Shanghai, Shandong Inquiry
Batchno.20250129 25g In stock Shandong Inquiry
Batchno.20250920 500mg In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20251215 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250304 100g In stock Shanghai Inquiry
Batchno.20250725 10g In stock Shanghai Inquiry
Batchno.20250502 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250213 25g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20250502 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-051449
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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: >95%
  • Inventory rows with stock: 5
  • 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 140924-50-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 5 In Stock Hong Kong Inquiry
5g >95% 5 In Stock Beijing Inquiry
10g >95% 5 In Stock Shenzhen Inquiry
25g >95% 5 In Stock Beijing Inquiry
100g >95% 5 In Stock Beijing Inquiry

140924-50-1 / 1,4-bis[(R)-[(2S,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methoxy]phthalazine

Standard CAS: 140924-50-1 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
140924-50-1
Multi CAS
No
Molecular Formula
C48H54N6O4
Molecular Weight
779.000000
Exact Mass
778.420654
SMILES
CC[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](C3=C4C=C(C=CC4=NC=C3)OC)OC5=NN=C(C6=CC=CC=C65)O[C@@H]([C@@H]7C[C@@H]8CCN7C[C@@H]8CC)C9=C1C=C(C=CC1=NC=C9)OC
InChI
InChI=1S/C48H54N6O4/c1-5-29-27-53-21-17-31(29)23-43(53)45(35-15-19-49-41-13-11-33(55-3)25-39(35)41)57-47-37-9-7-8-10-38(37)48(52-51-47)58-46(44-24-32-18-22-54(44)28-30(32)6-2)36-16-20-50-42-14-12-34(56-4)26-40(36)42/h7-16,19-20,25-26,29-32,43-46H,5-6,17-18,21-24,27-28H2,1-4H3/t29-,30-,31-,32-,43-,44-,45+,46+/m0/s1
InChIKey
YUCBLVFHJWOYDN-PDNPBWJSSA-N

Computed Properties

Structural Parameters

Heavy atom count
58
Aromatic heavy atom count
30
Fraction Csp3
0.46
Rotatable bonds
12
H-bond acceptors
10
Molar refractivity
226.6
TPSA
94.96

LogP / Solubility

WLOGP
9.22
MLOGP
8.19
XLogP3
8.8
Consensus LogP
8.74
Log S (ESOL)
-10.07
Class (ESOL)
Insoluble
Log S (Ali)
-12.61
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-13.82
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.92

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
10

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H317 (97.5%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement Codes
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501

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