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CAS 6055-19-2 Cyclophosphamide Monohydrate molecular structure lightbox
CAS RN: 6055-19-2

Cyclophosphamide Monohydrate

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250725 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong, Guangdong, Hebei, Chongqing Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250113 100mg In stock Shandong Inquiry
Batchno.20250630 25mg In stock Shanghai, Shandong, Chongqing, Hebei Inquiry
Batchno.20250430 500mg In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
  • Product code: ICTC2236
  • Purity/Analytical Methods: >98.0%(N)
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6055-19-2 / N,N-bis(2-chloroethyl)-2-oxo-1,3,2lambda5-oxazaphosphinan-2-amine;hydrate

Standard CAS: 6055-19-2 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
6055-19-2
Multi CAS
Yes
Molecular Formula
C7H17CL2N2O3P
Molecular Weight
279.100000
Exact Mass
278.035385
InChI
InChI=1S/C7H15Cl2N2O2P.H2O/c8-2-5-11(6-3-9)14(12)10-4-1-7-13-14;/h1-7H2,(H,10,12);1H2
InChIKey
PWOQRKCAHTVFLB-UHFFFAOYSA-N

Physical Properties

Melting Point
121 to 127 °F (NTP, 1992)
Physical Description
Cyclophosphamide monohydrate appears as fine white crystalline powder with a slightly bitter taste. Little or no odor. (NTP, 1992) White odorless solid; Liquefies upon loss of crystallization water; Darkens on light exposure; [ICSC] White odorless crystalline solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
5
H-bond acceptors
2
H-bond donors
1
Molar refractivity
62.81
TPSA
73.07

LogP / Solubility

WLOGP
1.06
MLOGP
0.94
XLogP3
1.06
Consensus LogP
1.02
Log S (ESOL)
-1.91
Class (ESOL)
Soluble
Log S (Ali)
-2.61
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.95
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.67

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2

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