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CAS 203792-32-9 5-(AMINOMETHYL)FURAN-2-CARBONITRILE HYDROCHLORIDE molecular structure lightbox
CAS RN: 203792-32-9

5-(AMINOMETHYL)FURAN-2-CARBONITRILE HYDROCHLORIDE

Product Availability

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2 package records0 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250713 100mg Out of stock Inquiry
Batchno.20250324 250mg Out of stock Inquiry
  • Product code: SSC-095921
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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: 1g
  • Available purity: ≥95%
  • 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 203792-32-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

203792-32-9 / 5-(aminomethyl)furan-2-carbonitrile;hydrochloride

Standard CAS: 203792-32-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
203792-32-9
Multi CAS
No
Molecular Formula
C6H7ClN2O
Molecular Weight
158.580000
Exact Mass
158.024691
SMILES
C1=C(OC(=C1)C#N)CN.Cl
InChI
InChI=1S/C6H6N2O.ClH/c7-3-5-1-2-6(4-8)9-5;/h1-2H,3,7H2;1H
InChIKey
VXYGVONDVBPKOY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
38.56
TPSA
62.95

LogP / Solubility

WLOGP
1.03
MLOGP
0.9
XLogP3
1.03
Consensus LogP
0.99
Log S (ESOL)
-1.78
Class (ESOL)
Soluble
Log S (Ali)
-1.61
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.67
Class (SILICOS-IT)
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)
-2.95

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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