CAS RN: 201677-61-4

Sivelestat sodium

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6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260630 100mg In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20250605 10mg In stock Shanghai Inquiry
Batchno.20260307 1mg In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20250321 50mg In stock Shanghai Inquiry
Batchno.20250916 5mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250208 5mg / 25mg / 100mg / 250mg Confirm by inquiry Shanghai, Guangdong, Shandong 5-7 business days Inquiry
  • Product code: starshine_CAS201677-61-4
  • Purity/Analytical Methods: >99.0%
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201677-61-4 / sodium;2-[[2-[[4-(2,2-dimethylpropanoyloxy)phenyl]sulfonylamino]benzoyl]amino]acetate;tetrahydrate

Standard CAS: 201677-61-4 Multi CAS: No

Basic Information

CAS
201677-61-4
Multi CAS
No
Molecular Formula
C20H29N2NaO11S
Molecular Weight
528.500000
Exact Mass
528.138975
SMILES
CC(C)(C)C(=O)OC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCC(=O)[O-].O.O.O.O.[Na+]
InChI
InChI=1S/C20H22N2O7S.Na.4H2O/c1-20(2,3)19(26)29-13-8-10-14(11-9-13)30(27,28)22-16-7-5-4-6-15(16)18(25)21-12-17(23)24;;;;;/h4-11,22H,12H2,1-3H3,(H,21,25)(H,23,24);;4*1H2/q;+1;;;;/p-1
InChIKey
PLHREJBSQUSUCW-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
35
Aromatic heavy atom count
12
Fraction Csp3
0.25
Rotatable bonds
7
H-bond acceptors
7
H-bond donors
2
Molar refractivity
120.58
TPSA
267.7

LogP / Solubility

WLOGP
-5.38
MLOGP
-4.69
XLogP3
-5.38
Consensus LogP
-5.15
Log S (ESOL)
0.48
Class (ESOL)
Highly soluble
Log S (Ali)
-0.01
Class (Ali)
Very soluble
Log S (SILICOS-IT)
0.53
Class (SILICOS-IT)
Highly 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)
-9.76

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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