[email protected]
CAS 1203680-76-5 3-[(4-Chlorophenyl)methoxy]-N-[(1S)-1-phenylethyl]thiophene-2-carboxamide molecular structure lightbox
CAS RN: 1203680-76-5

3-[(4-Chlorophenyl)methoxy]-N-[(1S)-1-phenylethyl]thiophene-2-carboxamide

Product Availability

Choose a grade to view its available package options.

11 package records11 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250722 100mg In stock Shanghai, Chengdu Inquiry
Batchno.20250819 1g In stock Shanghai Inquiry
Batchno.20250719 250mg In stock Shanghai Inquiry
Batchno.20260122 25mg In stock Shanghai Inquiry
Batchno.20251109 50mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250726 100mg In stock Inquiry
Batchno.20250908 10mg In stock Inquiry
Batchno.20250427 250mg In stock Inquiry
Batchno.20250601 25mg In stock Inquiry
Batchno.20250801 50mg In stock Inquiry
Batchno.20251010 5mg In stock Inquiry
  • Product code: starshine_CAS1203680-76-5
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1203680-76-5 / 3-[(4-chlorophenyl)methoxy]-N-[(1S)-1-phenylethyl]thiophene-2-carboxamide

as1949490 | 3-[(4-Chlorophenyl)methoxy]-N-[(1S)-1-phenylethyl]thiophene-2-carboxamide | AS-1949490

Standard CAS: 1203680-76-5 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1203680-76-5
Multi CAS
Yes
Molecular Formula
C20H18ClNO2S
Molecular Weight
371.900000
Exact Mass
371.074678
SMILES
C[C@@H](C1=CC=CC=C1)NC(=O)C2=C(C=CS2)OCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C20H18ClNO2S/c1-14(16-5-3-2-4-6-16)22-20(23)19-18(11-12-25-19)24-13-15-7-9-17(21)10-8-15/h2-12,14H,13H2,1H3,(H,22,23)/t14-/m0/s1
InChIKey
RFZPGNRLOKVZJY-AWEZNQCLSA-N
Synonyms
as1949490 3-[(4-Chlorophenyl)methoxy]-N-[(1S)-1-phenylethyl]thiophene-2-carboxamide AS-1949490 3-((4-chlorophenyl)methoxy)-N-((1S)-1-phenylethyl)thiophene-2-carboxamide RefChem:916287

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
17
Fraction Csp3
0.15
Rotatable bonds
6
H-bond acceptors
3
H-bond donors
1
Molar refractivity
102.43
TPSA
38.33

LogP / Solubility

WLOGP
5.47
MLOGP
4.84
XLogP3
5.2
Consensus LogP
5.17
Log S (ESOL)
-5.7
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.56
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.34
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.1

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

Customers Also Viewed

Get In Touch

Contact Us