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CAS 63762-74-3 6-CHLOROMELATONIN molecular structure lightbox
CAS RN: 63762-74-3

6-CHLOROMELATONIN

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7 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250802 10mg In stock Shanghai, Shandong, Hebei Inquiry
Batchno.20260526 5mg Out of stock 8-10 business days Inquiry
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Batchno.20250707 10mg In stock Inquiry
Batchno.20250608 1mg In stock Inquiry
Batchno.20250701 25mg In stock Inquiry
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Batchno.20250308 5mg In stock Inquiry
  • Product code: starshine_CAS63762-74-3
  • Purity/Analytical Methods: >99.0%
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63762-74-3 / N-[2-(6-chloro-5-methoxy-1H-indol-3-yl)ethyl]acetamide

Standard CAS: 63762-74-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
63762-74-3
Multi CAS
Yes
Molecular Formula
C13H15CLN2O2
Molecular Weight
266.720000
Exact Mass
266.082205
InChI
InChI=1S/C13H15ClN2O2/c1-8(17)15-4-3-9-7-16-12-6-11(14)13(18-2)5-10(9)12/h5-7,16H,3-4H2,1-2H3,(H,15,17)
InChIKey
LUINDDOUWHRIPW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
9
Fraction Csp3
0.31
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
2
Molar refractivity
72.25
TPSA
54.12

LogP / Solubility

WLOGP
2.51
MLOGP
2.22
XLogP3
2.2
Consensus LogP
2.31
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.56
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.96
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.57

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5

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