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CAS 139756-04-0 1H-Pyrazole-5-carboxaMide, 1-Methyl-4-[(2-propoxybenzoyl)aMino]-3-propyl- molecular structure lightbox
CAS RN: 139756-04-0

1H-Pyrazole-5-carboxaMide, 1-Methyl-4-[(2-propoxybenzoyl)aMino]-3-propyl-

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250727 100g In stock Shanghai, Shenzhen Inquiry
Batchno.20260330 1g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20260621 250mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20251106 25g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260626 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-050313
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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: 25g
  • 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 139756-04-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Shenzhen Inquiry

139756-04-0 / 1-methyl-4-[(2-propoxybenzoyl)amino]-3-propylpyrazole-5-carboxamide

Standard CAS: 139756-04-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
139756-04-0
Multi CAS
No
Molecular Formula
C18H24N4O3
Molecular Weight
344.400000
Exact Mass
344.184841
SMILES
CCCC1=NN(C(=C1NC(=O)C2=CC=CC=C2OCCC)C(=O)N)C
InChI
InChI=1S/C18H24N4O3/c1-4-8-13-15(16(17(19)23)22(3)21-13)20-18(24)12-9-6-7-10-14(12)25-11-5-2/h6-7,9-10H,4-5,8,11H2,1-3H3,(H2,19,23)(H,20,24)
InChIKey
OYHROMDBMGIQCJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
11
Fraction Csp3
0.39
Rotatable bonds
8
H-bond acceptors
5
H-bond donors
2
Molar refractivity
95.9
TPSA
99.24

LogP / Solubility

WLOGP
2.51
MLOGP
2.23
XLogP3
2.9
Consensus LogP
2.55
Log S (ESOL)
-3.36
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.2
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.94
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.04

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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