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CAS 10299-71-5 CYCLOPENTA[4,5]PYRROLO[2,3-B]PYRIDINE, 5,6,7,8-TETRAHYDRO molecular structure lightbox
CAS RN: 10299-71-5

CYCLOPENTA[4,5]PYRROLO[2,3-B]PYRIDINE, 5,6,7,8-TETRAHYDRO

  • Product code: SSC-004369
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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 10299-71-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

10299-71-5 / 7,9-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene

CYCLOPENTA[4,5]PYRROLO[2,3-B]PYRIDINE, 5,6,7,8-TETRAHYDRO | 5,6,7,8-Tetrahydrocyclopenta[4,5]pyrrolo[2,3-b]pyridine | 7,9-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene

Standard CAS: 10299-71-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
10299-71-5
Multi CAS
Yes
Molecular Formula
C10H10N2
Molecular Weight
158.200000
Exact Mass
158.084398
SMILES
C1CC2=C(C1)NC3=C2C=CC=N3
InChI
InChI=1S/C10H10N2/c1-3-7-8-4-2-6-11-10(8)12-9(7)5-1/h2,4,6H,1,3,5H2,(H,11,12)
InChIKey
GNZGBYZTHJYVQD-UHFFFAOYSA-N
Synonyms
CYCLOPENTA[4,5]PYRROLO[2,3-B]PYRIDINE, 5,6,7,8-TETRAHYDRO 5,6,7,8-Tetrahydrocyclopenta[4,5]pyrrolo[2,3-b]pyridine 7,9-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene AB-337/25021008 Cyclopenta[4,5]pyrrolo[2,3-b]pyridine,5,6,7,8-tetrahydro

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
9
Fraction Csp3
0.3
H-bond acceptors
1
H-bond donors
1
Molar refractivity
48.12
TPSA
28.68

LogP / Solubility

WLOGP
2.05
MLOGP
1.8
XLogP3
2
Consensus LogP
1.95
Log S (ESOL)
-2.67
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.34
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.39
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)
-2.23

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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