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CAS 1334169-90-2 MPEG8-NH-Mal molecular structure lightbox
CAS RN: 1334169-90-2

MPEG8-NH-Mal

  • Product code: SSC-040124
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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
  • 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 1334169-90-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g -- 2 In Stock Shanghai Inquiry
0.1g >97% 2 In Stock Shenzhen Inquiry
0.25g -- 2 In Stock Shanghai Inquiry
0.25g >97% 2 In Stock Beijing Inquiry
1g -- 2 In Stock Shanghai Inquiry
1g >97% 2 In Stock Beijing Inquiry

1334169-90-2 / 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide

Standard CAS: 1334169-90-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1334169-90-2
Multi CAS
No
Molecular Formula
C24H42N2O11
Molecular Weight
534.600000
Exact Mass
534.278860
SMILES
COCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCN1C(=O)C=CC1=O
InChI
InChI=1S/C24H42N2O11/c1-30-8-9-32-12-13-34-16-17-36-20-21-37-19-18-35-15-14-33-11-10-31-7-5-25-22(27)4-6-26-23(28)2-3-24(26)29/h2-3H,4-21H2,1H3,(H,25,27)
InChIKey
DYKKRMSENAYADQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
37
Fraction Csp3
0.79
Rotatable bonds
27
H-bond acceptors
11
H-bond donors
1
Molar refractivity
131.1
TPSA
140.32

LogP / Solubility

WLOGP
-0.82
MLOGP
-0.68
XLogP3
-1.4
Consensus LogP
-0.97
Log S (ESOL)
-0.86
Class (ESOL)
Very soluble
Log S (Ali)
-3.35
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-5.69
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-6.56

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

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