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CAS 161851-25-8 3-AMINO-1-METHYL-1,3-DIHYDRO-2H-INDOL-2-ONEHYDROCHLORIDE molecular structure lightbox
CAS RN: 161851-25-8

3-AMINO-1-METHYL-1,3-DIHYDRO-2H-INDOL-2-ONEHYDROCHLORIDE

Product Availability

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4 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250409 100mg Out of stock Inquiry
Batchno.20250313 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
Batchno.20260206 1g Out of stock Inquiry
Batchno.20250128 250mg Out of stock Inquiry
  • Product code: SSC-069401
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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 161851-25-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

161851-25-8 / 3-amino-1-methyl-3H-indol-2-one;hydrochloride

Standard CAS: 161851-25-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
161851-25-8
Multi CAS
No
Molecular Formula
C9H11ClN2O
Molecular Weight
198.650000
Exact Mass
198.055991
SMILES
CN1C2=CC=CC=C2C(C1=O)N.Cl
InChI
InChI=1S/C9H10N2O.ClH/c1-11-7-5-3-2-4-6(7)8(10)9(11)12;/h2-5,8H,10H2,1H3;1H
InChIKey
QGSSMUMEQPEIBQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.22
H-bond acceptors
2
H-bond donors
1
Molar refractivity
54.03
TPSA
46.33

LogP / Solubility

WLOGP
1.08
MLOGP
0.95
XLogP3
1.08
Consensus LogP
1.04
Log S (ESOL)
-2.1
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.97
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.85
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)
-3.16

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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