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CAS 6300-37-4 4-[4-(PHENYLAZO)PHENYLAZO]-O-CRESOL molecular structure lightbox
CAS RN: 6300-37-4

4-[4-(PHENYLAZO)PHENYLAZO]-O-CRESOL

Product Availability

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3 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250609 10mg Out of stock Inquiry
Batchno.20250216 5mg Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250918 100mg In stock Shanghai Inquiry
  • Product code: starshine_CAS6300-37-4
  • Purity/Analytical Methods: >99.0%
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6300-37-4 / 2-methyl-4-[(4-phenyldiazenylphenyl)diazenyl]phenol

Standard CAS: 6300-37-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
6300-37-4
Multi CAS
No
Molecular Formula
C19H16N4O
Molecular Weight
316.400000
Exact Mass
316.132411
InChI
InChI=1S/C19H16N4O/c1-14-13-18(11-12-19(14)24)23-22-17-9-7-16(8-10-17)21-20-15-5-3-2-4-6-15/h2-13,24H,1H3
InChIKey
VGKYEIFFSOPYEW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
18
Fraction Csp3
0.05
Rotatable bonds
4
H-bond acceptors
5
H-bond donors
1
Molar refractivity
94.08
TPSA
69.67

LogP / Solubility

WLOGP
6.53
MLOGP
5.76
XLogP3
5.5
Consensus LogP
5.93
Log S (ESOL)
-6.21
Class (ESOL)
Insoluble
Log S (Ali)
-6.87
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.62
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.01

Drug-likeness / Medicinal Chemistry

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

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