CS-1001024
3-[(7,8,10,11,13,14-Hexahydro[1,4,7,10]tetraoxacyclododecino[2,3-g]quinazolin-4-yl)amino]benzeneacetic acid
Manufacturer: ChemScene
CAS Number: 1318600-04-2
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₂H₂₃N₃O₆
Molecular Weight
425.43
Synonyms
None
SMILES
O=C(O)CC=1C=CC=C(C1)NC=2N=CN=C3C=C4OCCOCCOCCOC4=CC32
Tpsa
112.03
Logp
2.8049
H Acceptors
8
H Donors
2
Rotatable Bonds
4
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₃N₃O₆
Molecular Weight: 425.43
Synonyms: None
SMILES: O=C(O)CC=1C=CC=C(C1)NC=2N=CN=C3C=C4OCCOCCOCCOC4=CC32
Tpsa: 112.03
Logp: 2.8049
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₃N₃O₆
Molecular Weight:
425.43
Synonyms:
None
SMILES:
O=C(O)CC=1C=CC=C(C1)NC=2N=CN=C3C=C4OCCOCCOCCOC4=CC32
Tpsa:
112.03
Logp:
2.8049
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₆BrClO₂
Molecular Weight: 355.65
Synonyms: None
SMILES: ClC1=CC=C(Br)C=C1C(OC)C2=CC=C(OCC)C=C2
Tpsa: 18.46
Logp: 5.237
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₆BrClO₂
Molecular Weight:
355.65
Synonyms:
None
SMILES:
ClC1=CC=C(Br)C=C1C(OC)C2=CC=C(OCC)C=C2
Tpsa:
18.46
Logp:
5.237
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
5
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₃₀O₆
Molecular Weight: 414.49
Synonyms: None
SMILES: C(CO)(=O)[C@]12[C@]3(C)C(=C[C@]1(OC(C)(C)O2)[H])[C@]4([C@]([C@@H](O)C3)([C@]5(C)C(CC4)=CC(=O)C=C5)[H])[H]
Tpsa: 93.06
Logp: 2.2468
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₃₀O₆
Molecular Weight:
414.49
Synonyms:
None
SMILES:
C(CO)(=O)[C@]12[C@]3(C)C(=C[C@]1(OC(C)(C)O2)[H])[C@]4([C@]([C@@H](O)C3)([C@]5(C)C(CC4)=CC(=O)C=C5)[H])[H]
Tpsa:
93.06
Logp:
2.2468
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₇N₃O₃
Molecular Weight: 157.13
Synonyms: None
SMILES: O=C(OC)C1=NN=C(OC)N1
Tpsa: 77.1
Logp: -0.4001
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₇N₃O₃
Molecular Weight:
157.13
Synonyms:
None
SMILES:
O=C(OC)C1=NN=C(OC)N1
Tpsa:
77.1
Logp:
-0.4001
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2