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CAS 1084328-81-3 1H-Indol-7-aMine, 3-Methyl- molecular structure lightbox
CAS RN: 1084328-81-3

1H-Indol-7-aMine, 3-Methyl-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250806 100mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-009759
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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
  • 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 1084328-81-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ＞97% 0 Out of Stock Hong Kong Inquiry

1084328-81-3 / 3-methyl-1H-indol-7-amine

3-methyl-1H-indol-7-amine | MFCD11036371 | 1H-Indol-7-amine, 3-methyl-

Standard CAS: 1084328-81-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1084328-81-3
Multi CAS
No
Molecular Formula
C9H10N2
Molecular Weight
146.190000
Exact Mass
146.084398
SMILES
CC1=CNC2=C1C=CC=C2N
InChI
InChI=1S/C9H10N2/c1-6-5-11-9-7(6)3-2-4-8(9)10/h2-5,11H,10H2,1H3
InChIKey
XAFNYUFKUVBRPL-UHFFFAOYSA-N
Synonyms
3-methyl-1H-indol-7-amine MFCD11036371 1H-Indol-7-amine, 3-methyl- SCHEMBL7089054 XAFNYUFKUVBRPL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.11
H-bond acceptors
1
H-bond donors
2
Molar refractivity
47.45
TPSA
41.81

LogP / Solubility

WLOGP
2.06
MLOGP
1.81
XLogP3
1.7
Consensus LogP
1.86
Log S (ESOL)
-2.65
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.25
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.32
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.15

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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