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CAS 334634-19-4 2-(1,1-diMethylpropyl)-4-[3-(1,1-diMethylpropyl)-4-oxo-1(4H)-naphthalenylidene]-1(4H)-Naphthalenone molecular structure lightbox
CAS RN: 334634-19-4

2-(1,1-diMethylpropyl)-4-[3-(1,1-diMethylpropyl)-4-oxo-1(4H)-naphthalenylidene]-1(4H)-Naphthalenone

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250213 200mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-139531
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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 334634-19-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Hong Kong Inquiry

334634-19-4 / (4Z)-2-(2-methylbutan-2-yl)-4-[3-(2-methylbutan-2-yl)-4-oxonaphthalen-1-ylidene]naphthalen-1-one

Standard CAS: 334634-19-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
334634-19-4
Multi CAS
Yes
Molecular Formula
C30H32O2
Molecular Weight
424.600000
Exact Mass
424.240230
InChI
InChI=1S/C30H32O2/c1-7-29(3,4)25-17-23(19-13-9-11-15-21(19)27(25)31)24-18-26(30(5,6)8-2)28(32)22-16-12-10-14-20(22)24/h9-18H,7-8H2,1-6H3/b24-23-
InChIKey
WCHVKZNNCBGHEU-VHXPQNKSSA-N

Computed Properties

Structural Parameters

Heavy atom count
32
Aromatic heavy atom count
12
Fraction Csp3
0.33
Rotatable bonds
4
H-bond acceptors
2
Molar refractivity
132.67
TPSA
34.14

LogP / Solubility

WLOGP
7.72
MLOGP
6.82
XLogP3
7.9
Consensus LogP
7.48
Log S (ESOL)
-7.35
Class (ESOL)
Insoluble
Log S (Ali)
-8.61
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.3
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.17

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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