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CAS 1207891-03-9 1H-Pyrazol-3-amine, 1-[4-(trifluoromethyl)phenyl]- molecular structure lightbox
CAS RN: 1207891-03-9

1H-Pyrazol-3-amine, 1-[4-(trifluoromethyl)phenyl]-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260321 100mg / 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-022058
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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: 0.1g, 0.25g, 1g, 5g
  • Available purity: ＞97%
  • 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 1207891-03-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ＞97% 0 Out of Stock Hong Kong Inquiry
0.25g ＞97% 0 Out of Stock Hong Kong Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

1207891-03-9 / 1-[4-(trifluoromethyl)phenyl]pyrazol-3-amine

1-(4-(Trifluoromethyl)phenyl)-1H-pyrazol-3-amine | MFCD16835995 | 1-[4-(trifluoromethyl)phenyl]pyrazol-3-amine

Standard CAS: 1207891-03-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1207891-03-9
Multi CAS
Yes
Molecular Formula
C10H8F3N3
Molecular Weight
227.190000
Exact Mass
227.067032
SMILES
C1=CC(=CC=C1C(F)(F)F)N2C=CC(=N2)N
InChI
InChI=1S/C10H8F3N3/c11-10(12,13)7-1-3-8(4-2-7)16-6-5-9(14)15-16/h1-6H,(H2,14,15)
InChIKey
ZZLASVXJBCPLBM-UHFFFAOYSA-N
Synonyms
1-(4-(Trifluoromethyl)phenyl)-1H-pyrazol-3-amine MFCD16835995 1-[4-(trifluoromethyl)phenyl]pyrazol-3-amine 1-[4-(Trifluoromethyl)phenyl]-1H-pyrazol-3-amine SCHEMBL11614453

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
11
Fraction Csp3
0.1
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
52.98
TPSA
43.84

LogP / Solubility

WLOGP
2.47
MLOGP
2.18
XLogP3
2.4
Consensus LogP
2.35
Log S (ESOL)
-3.25
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.21
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.31
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.35

Drug-likeness / Medicinal Chemistry

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

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