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CAS 4551-72-8 1H-PYRROLE-2-CARBOXAMIDE molecular structure lightbox
CAS RN: 4551-72-8

1H-PYRROLE-2-CARBOXAMIDE

Product Availability

Choose a grade to view its available package options.

3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260628 1g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260313 250mg In stock Shanghai, Chengdu Inquiry
Batchno.20251108 5g Out of stock Inquiry
  • Product code: SSC-153257
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 4551-72-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 1 In Stock Hong Kong Inquiry
0.25g >95% 1 In Stock Hong Kong Inquiry
1g >95% 1 In Stock Hong Kong Inquiry
5g >95% 1 In Stock Beijing Inquiry

4551-72-8 / 1H-pyrrole-2-carboxamide

Standard CAS: 4551-72-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
4551-72-8
Multi CAS
Yes
Molecular Formula
C5H6N2O
Molecular Weight
110.110000
Exact Mass
110.048013
InChI
InChI=1S/C5H6N2O/c6-5(8)4-2-1-3-7-4/h1-3,7H,(H2,6,8)
InChIKey
RLOQBKJCOAXOLR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
2
Molar refractivity
29.31
TPSA
58.88

LogP / Solubility

WLOGP
0.11
MLOGP
0.09
XLogP3
0.2
Consensus LogP
0.13
Log S (ESOL)
-0.99
Class (ESOL)
Very soluble
Log S (Ali)
-0.54
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.59
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.31

Drug-likeness / Medicinal Chemistry

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

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