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CAS 683223-04-3 Urea, N-(2,2-dimethoxyethyl)-N-methyl- (9CI) molecular structure lightbox
CAS RN: 683223-04-3

Urea, N-(2,2-dimethoxyethyl)-N-methyl- (9CI)

  • Product code: SSC-178065
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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 683223-04-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

683223-04-3 / 1-(2,2-dimethoxyethyl)-1-methylurea

Standard CAS: 683223-04-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
683223-04-3
Multi CAS
No
Molecular Formula
C6H14N2O3
Molecular Weight
162.190000
Exact Mass
162.100442
InChI
InChI=1S/C6H14N2O3/c1-8(6(7)9)4-5(10-2)11-3/h5H,4H2,1-3H3,(H2,7,9)
InChIKey
FBDSOENCJOPOMH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.83
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
1
Molar refractivity
40.02
TPSA
64.79

LogP / Solubility

WLOGP
-0.38
MLOGP
-0.34
XLogP3
-1
Consensus LogP
-0.57
Log S (ESOL)
-0.34
Class (ESOL)
Very soluble
Log S (Ali)
-0.61
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.88
Class (SILICOS-IT)
Very 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)
-3.98

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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