Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl-
TL;DR: Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl- (CAS 78280-38-3) is a chemical compound with molecular formula C11H15Cl2N3O and molecular weight 275.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(2-chloroethyl)amino]-3-phenylurea
Also Known As: 1,1-Bis(2-chloroethyl)-4-phenylsemicarbazide, Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl-, 1-[bis(2-chloroethyl)amino]-3-phenylurea, 1,1-Bis(2-chloraethyl)-4-phenylsemicarbazid, 1,1-Bis(2-chloraethyl)-4-phenylsemicarbazid [German]
| Molecular Formula | C11H15Cl2N3O |
|---|---|
| Molecular Weight | 275.06 g/mol |
| LogP | 2.5027 |
| Topological Polar Surface Area | 44.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.0592 |
| Heavy Atoms | 17 |
| Complexity | 328.74823 |
Chemical Identifiers
| CAS Number | 78280-38-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NN(CCCl)CCCl |
Product Overview
Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl- (CAS 78280-38-3), with molecular formula C11H15Cl2N3O and molecular weight 275.06 g/mol. IUPAC: 1-[bis(2-chloroethyl)amino]-3-phenylurea.
Chemical Property Profile of Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl-
Property Insights of Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl-
The XLogP value of 2.5027 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl-. With a topological polar surface area (TPSA) of 44.37 Ų, Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl-?
The CAS number of Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl- is 78280-38-3.
What is the molecular formula of Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl-?
The molecular formula of Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl- is C11H15Cl2N3O.
What is the molecular weight of Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl-?
The molecular weight of Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl- is 275.06 g/mol.
Where can I buy Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl-?
You can request a quote for Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Semicarbazide, 1,1-bis(2-chloroethyl)-4-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.