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CAS 1151893-81-0 (S)-2-(2-(5-chloro-N-(4-(5-((5-chlorothiophene-2-carboxamido)methyl)-2-oxooxazolidin-3-yl)phenyl)thiophene-2-carboxamido)ethoxy)acetic acid molecular structure lightbox
CAS RN: 1151893-81-0

(S)-2-(2-(5-chloro-N-(4-(5-((5-chlorothiophene-2-carboxamido)methyl)-2-oxooxazolidin-3-yl)phenyl)thiophene-2-carboxamido)ethoxy)acetic acid

Product Availability

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6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251230 100mg In stock Shanghai Inquiry
Batchno.20260604 10mg In stock Shanghai Inquiry
Batchno.20250607 1g In stock Shanghai Inquiry
Batchno.20251221 250mg In stock Shanghai Inquiry
Batchno.20250603 25mg In stock Shanghai Inquiry
Batchno.20250604 50mg In stock Shanghai Inquiry
  • Product code: SSC-014877
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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: ≥95%
  • 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 1151893-81-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

1151893-81-0 / 2-[2-[N-(5-chlorothiophene-2-carbonyl)-4-[(5S)-5-[[(5-chlorothiophene-2-carbonyl)amino]methyl]-2-oxo-1,3-oxazolidin-3-yl]anilino]ethoxy]acetic acid

Rivaroxaban Impurity | (S)-2-(2-(5-CHLORO-N-(4-(5-((5-CHLOROTHIOPHENE-2-CARBOXAMIDO)METHYL)-2-OXOOXAZOLIDIN-3-YL)PHENYL)THIOPHENE-2-CARBOXAMIDO)ETHOXY)ACETIC ACID | Rivaroxaban N-hydrolyse N-5-chlorothiophene-2-carbaldehyde

Standard CAS: 1151893-81-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1151893-81-0
Multi CAS
Yes
Molecular Formula
C24H21Cl2N3O7S2
Molecular Weight
598.500000
Exact Mass
597.019798
SMILES
C1[C@@H](OC(=O)N1C2=CC=C(C=C2)N(CCOCC(=O)O)C(=O)C3=CC=C(S3)Cl)CNC(=O)C4=CC=C(S4)Cl
InChI
InChI=1S/C24H21Cl2N3O7S2/c25-19-7-5-17(37-19)22(32)27-11-16-12-29(24(34)36-16)15-3-1-14(2-4-15)28(9-10-35-13-21(30)31)23(33)18-6-8-20(26)38-18/h1-8,16H,9-13H2,(H,27,32)(H,30,31)/t16-/m0/s1
InChIKey
XEOFNNZMYBBFPT-INIZCTEOSA-N
Synonyms
Rivaroxaban Impurity (S)-2-(2-(5-CHLORO-N-(4-(5-((5-CHLOROTHIOPHENE-2-CARBOXAMIDO)METHYL)-2-OXOOXAZOLIDIN-3-YL)PHENYL)THIOPHENE-2-CARBOXAMIDO)ETHOXY)ACETIC ACID Rivaroxaban N-hydrolyse N-5-chlorothiophene-2-carbaldehyde R7AV86WZ2E 2-[2-[N-(5-chlorothiophene-2-carbonyl)-4-[(5S)-5-[[(5-chlorothiophene-2-carbonyl)amino]methyl]-2-oxo-1,3-oxazolidin-3-yl]anilino]ethoxy]acetic acid

Computed Properties

Structural Parameters

Heavy atom count
38
Aromatic heavy atom count
16
Fraction Csp3
0.25
Rotatable bonds
11
H-bond acceptors
8
H-bond donors
2
Molar refractivity
145.18
TPSA
125.48

LogP / Solubility

WLOGP
4.62
MLOGP
4.11
XLogP3
4.9
Consensus LogP
4.54
Log S (ESOL)
-6.05
Class (ESOL)
Insoluble
Log S (Ali)
-7.8
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.7
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.09

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

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