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CAS 1599440-08-0 3,10-Dioxa-5,8-diazaundecanoic acid, 11-(9H-fluoren-9-yl)-6,9-dioxo- molecular structure lightbox
CAS RN: 1599440-08-0

3,10-Dioxa-5,8-diazaundecanoic acid, 11-(9H-fluoren-9-yl)-6,9-dioxo-

Product Availability

Choose a grade to view its available package options.

6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260429 100mg / 250mg / 1g / 5g / 25g Confirm by inquiry Shanghai Inquiry
Batchno.20250501 10g In stock Shanghai Inquiry
Batchno.20250826 1g In stock Shanghai Inquiry
Batchno.20251121 250mg In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20260109 25g In stock Shanghai Inquiry
Batchno.20251031 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-067927
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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: 0.1g, 0.25g, 1g, 5g, 10g, 25g
  • Available purity: >97%
  • Inventory rows with stock: 6
  • 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 1599440-08-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >97% 1 In Stock Shenzhen Inquiry
0.25g >97% 1 In Stock Shanghai Inquiry
1g >97% 1 In Stock Beijing Inquiry
5g >97% 1 In Stock Hong Kong Inquiry
10g >97% 1 In Stock Hong Kong Inquiry
25g >97% 1 In Stock Shanghai Inquiry

1599440-08-0 / 2-[[[2-(9H-fluoren-9-ylmethoxycarbonylamino)acetyl]amino]methoxy]acetic acid

Standard CAS: 1599440-08-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1599440-08-0
Multi CAS
No
Molecular Formula
C20H20N2O6
Molecular Weight
384.400000
Exact Mass
384.132136
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCC(=O)NCOCC(=O)O
InChI
InChI=1S/C20H20N2O6/c23-18(22-12-27-11-19(24)25)9-21-20(26)28-10-17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,17H,9-12H2,(H,21,26)(H,22,23)(H,24,25)
InChIKey
LIBCNUNKCWYZAX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
28
Aromatic heavy atom count
12
Fraction Csp3
0.25
Rotatable bonds
8
H-bond acceptors
5
H-bond donors
3
Molar refractivity
99.67
TPSA
113.96

LogP / Solubility

WLOGP
1.7
MLOGP
1.52
XLogP3
1.9
Consensus LogP
1.71
Log S (ESOL)
-3.08
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.94
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.53
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.86

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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