[email protected]
CAS 332121-93-4 Benzoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-5-methoxy- (9CI) molecular structure lightbox
CAS RN: 332121-93-4

Benzoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-5-methoxy- (9CI)

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260306 50mg / 200mg Out of stock 15 business days Inquiry
  • Product code: SSC-139198
GET A QUOTE
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: 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 332121-93-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry

332121-93-4 / 2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methoxybenzoic acid

Standard CAS: 332121-93-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
332121-93-4
Multi CAS
No
Molecular Formula
C23H19NO5
Molecular Weight
389.400000
Exact Mass
389.126323
InChI
InChI=1S/C23H19NO5/c1-28-14-10-11-21(19(12-14)22(25)26)24-23(27)29-13-20-17-8-4-2-6-15(17)16-7-3-5-9-18(16)20/h2-12,20H,13H2,1H3,(H,24,27)(H,25,26)
InChIKey
KSFFCSQFNZYKTE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
29
Aromatic heavy atom count
18
Fraction Csp3
0.13
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
2
Molar refractivity
108.65
TPSA
84.86

LogP / Solubility

WLOGP
4.75
MLOGP
4.21
XLogP3
4.7
Consensus LogP
4.55
Log S (ESOL)
-5.38
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.19
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.74
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.72

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us