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CAS 183319-69-9 Erlotinib hydrochloride molecular structure lightbox
CAS RN: 183319-69-9

Erlotinib hydrochloride

Product Availability

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7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityInquiry
Batchno.20250206 1ml In stock Inquiry
Batch No.PackageAvailabilityInquiry
Batchno.20251205 100g In stock Inquiry
Batchno.20260206 100mg In stock Inquiry
Batchno.20250219 1g In stock Inquiry
Batchno.20250117 25g In stock Inquiry
Batchno.20251127 500mg In stock Inquiry
Batchno.20250820 5g In stock Inquiry
  • Product code: SSC-084821
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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: 25g
  • 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 183319-69-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g >97% 0 Out of Stock Beijing Inquiry

183319-69-9 / N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine;hydrochloride

Standard CAS: 183319-69-9 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
183319-69-9
Multi CAS
No
Molecular Formula
C22H24ClN3O4
Molecular Weight
429.900000
Exact Mass
429.145534
SMILES
COCCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C)OCCOC.Cl
InChI
InChI=1S/C22H23N3O4.ClH/c1-4-16-6-5-7-17(12-16)25-22-18-13-20(28-10-8-26-2)21(29-11-9-27-3)14-19(18)23-15-24-22;/h1,5-7,12-15H,8-11H2,2-3H3,(H,23,24,25);1H
InChIKey
GTTBEUCJPZQMDZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
16
Fraction Csp3
0.27
Rotatable bonds
10
H-bond acceptors
7
H-bond donors
1
Molar refractivity
119.19
TPSA
74.73

LogP / Solubility

WLOGP
3.83
MLOGP
3.4
XLogP3
3.83
Consensus LogP
3.69
Log S (ESOL)
-4.65
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.85
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.83
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.63

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

Pictogram(s)
Irritant Health Hazard Environmental Hazard
Signal
Danger
GHS Hazard Statements
H302 (91.7%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (16.7%): Causes skin irritation [Warning Skin corrosion/irritation] H317 (25%): May cause an allergic skin reaction [Warning Sensitization, Skin] H319 (16.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H351 (25%): Suspected of causing cancer [Warning Carcinogenicity]
Precautionary Statement Codes
P203, P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P302+P352, P305+P351+P338, P318, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P405, and P501

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