[email protected]
CAS 57999-06-1 4-PHENYL-1H-PYRAZOL-5-AMINE molecular structure lightbox
CAS RN: 57999-06-1

4-PHENYL-1H-PYRAZOL-5-AMINE

Product Availability

Choose a grade to view its available package options.

6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260318 1g / 5g / 25g Out of stock 15 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260320 100g In stock Shanghai Inquiry
Batchno.20250430 10g In stock Shanghai Inquiry
Batchno.20260410 1g In stock Shanghai Inquiry
Batchno.20260427 25g In stock Shanghai Inquiry
Batchno.20250317 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS57999-06-1
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

57999-06-1 / 4-phenyl-1H-pyrazol-5-amine

Standard CAS: 57999-06-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
57999-06-1
Multi CAS
Yes
Molecular Formula
C9H9N3
Molecular Weight
159.190000
Exact Mass
159.079647
InChI
InChI=1S/C9H9N3/c10-9-8(6-11-12-9)7-4-2-1-3-5-7/h1-6H,(H3,10,11,12)
InChIKey
QEHKQNYBBLCFIJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
11
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
48.44
TPSA
54.7

LogP / Solubility

WLOGP
1.66
MLOGP
1.45
XLogP3
1.5
Consensus LogP
1.54
Log S (ESOL)
-2.48
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.06
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.19
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.51

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us