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CAS 71670-67-2 2-CHLORO-1H-NAPHTHO[2,3-D]IMIDAZOLE molecular structure lightbox
CAS RN: 71670-67-2

2-CHLORO-1H-NAPHTHO[2,3-D]IMIDAZOLE

  • Product code: SSC-181235
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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 71670-67-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 0 Out of Stock Hong Kong Inquiry

71670-67-2 / 2-chloro-3H-benzo[e]benzimidazole

Standard CAS: 71670-67-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
71670-67-2
Multi CAS
Yes
Molecular Formula
C11H7CLN2
Molecular Weight
202.640000
Exact Mass
202.029776
InChI
InChI=1S/C11H7ClN2/c12-11-13-9-6-5-7-3-1-2-4-8(7)10(9)14-11/h1-6H,(H,13,14)
InChIKey
YWUWVRWNTVWDHO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
13
H-bond acceptors
1
H-bond donors
1
Molar refractivity
58.61
TPSA
28.68

LogP / Solubility

WLOGP
3.37
MLOGP
2.97
XLogP3
3.7
Consensus LogP
3.35
Log S (ESOL)
-3.91
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.65
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.77
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.56

Drug-likeness / Medicinal Chemistry

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

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