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CAS 63404-86-4 5-(Chloroacetyl)-8-(phenylmethoxy)-2(1H)-quinolinone molecular structure lightbox
CAS RN: 63404-86-4

5-(Chloroacetyl)-8-(phenylmethoxy)-2(1H)-quinolinone

Product Availability

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3 package records3 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250106 100mg / 250mg / 1g Confirm by inquiry Shanghai 15 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260104 25mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260514 25mg / 100mg / 250mg Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-173067
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 63404-86-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

63404-86-4 / 5-(2-chloroacetyl)-8-phenylmethoxy-1H-quinolin-2-one

Standard CAS: 63404-86-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
63404-86-4
Multi CAS
Yes
Molecular Formula
C18H14CLNO3
Molecular Weight
327.800000
Exact Mass
327.066221
InChI
InChI=1S/C18H14ClNO3/c19-10-15(21)13-6-8-16(18-14(13)7-9-17(22)20-18)23-11-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,20,22)
InChIKey
AUFKEUKWVZCLQD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
23
Aromatic heavy atom count
16
Fraction Csp3
0.11
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
1
Molar refractivity
90.39
TPSA
59.16

LogP / Solubility

WLOGP
3.53
MLOGP
3.12
XLogP3
3.1
Consensus LogP
3.25
Log S (ESOL)
-4.28
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.8
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.32
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.21

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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