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CAS 41267-76-9 Coumarin 102 molecular structure lightbox
CAS RN: 41267-76-9

Coumarin 102

Product Availability

Choose a grade to view its available package options.

10 package records10 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250704 100mg In stock Inquiry
Batchno.20260429 1g In stock Inquiry
Batchno.20251123 200mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250704 100mg In stock Shanghai Inquiry
Batchno.20250314 10g In stock Shanghai Inquiry
Batchno.20250725 1g In stock Shanghai Inquiry
Batchno.20250728 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260504 50mg In stock Shanghai Inquiry
Batchno.20251110 50mg / 200mg / 1g / 5g Confirm by inquiry Shanghai, Shandong, Guangdong Inquiry
Batchno.20251006 5g In stock Shanghai Inquiry
  • Product code: SSC-149715
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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: ＞97%
  • 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 41267-76-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

41267-76-9 / 6-methyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),5,8-tetraen-4-one

Standard CAS: 41267-76-9 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
41267-76-9
Multi CAS
No
Molecular Formula
C16H17NO2
Molecular Weight
255.310000
Exact Mass
255.125929
InChI
InChI=1S/C16H17NO2/c1-10-8-14(18)19-16-12-5-3-7-17-6-2-4-11(15(12)17)9-13(10)16/h8-9H,2-7H2,1H3
InChIKey
XHXMPURWMSJENN-UHFFFAOYSA-N

Physical Properties

Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
10
Fraction Csp3
0.44
H-bond acceptors
3
Molar refractivity
76.08
TPSA
33.45

LogP / Solubility

WLOGP
2.8
MLOGP
2.47
XLogP3
2.7
Consensus LogP
2.66
Log S (ESOL)
-3.58
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.68
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.64
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.29

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2

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